![C44H53FN7O8 Guanosine, 5′-O- [bis (4-methoxyphenyl) phenylmethyl] -2′-deoxy-2′ – fluoro-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N, N-bis (1-methyl ethyl) phosphoramite (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C44H53FN7O8 Guanosine, 5′-O- [bis (4-methoxyphenyl) phenylmethyl] -2′-deoxy-2′ – fluoro-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N, N-bis (1-methyl ethyl) phosphoramite] (ACI) Foto egosipụtara](https://cdn.globalso.com/nvchem/C44H53FN7O8.png)
C44H53FN7O8 Guanosine, 5′-O- [bis (4-methoxyphenyl) phenylmethyl] -2′-deoxy-2′ – fluoro-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N, N-bis (1-methyl ethyl) phosphoramite (ACI)
Nọmba ndekọ CAS
144089-97-4
| Njirimara anụ ahụ igodo | Uru | Ọnọdụ |
| Ibu molekụla | 857.91 | - |
| pKa (buru amụma) | 9.16±0.20 | Okpomọkụ kachasị acidic: 25 Celsius |
Ọchịchị Canonical
N#CCCOP(OC1C(F)C(OC1COC(C=2C=CC=CC2)(C3=CC=C(OC)C=C3)C4=CC=C(OC)C=C4)N5C=NC=6C (=O)N=C(NC(=O)C(C)C)NC65)N(C(C) C)C(C)C
Isomeric SMILES
C(OC[C@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](F)[C@@ H](O1)N2C3=C(N=C2)C(=O)N=C(NC(C(C)C)=O)N3(C4=CC=C(OC)C =C4)(C5=CC=C(OC)C=C5)C6=CC=CC=C6
InChi
InChi= 1S/C44H53FN7O8P/c1-27(2)40(53)49-43-48-39-37(41(54)50-43)47-26-51(39)42-36(45)38(60-) 61 (58-24-12-23-46)52 (28 (3)4)29 (5) 6)35 (59-42)25-57-44 (30-13-10-9-11-14-30,31-15-19-33(55-7)20-16- 31)32-17-21-34(56-8)22-18-32/h9-11,13-22,26-29,35-36,38,42H,12, 24-25H2,1-8H3,(H2,48,49,50,53,54)/t35-,36-,38-,42-,61?/m1/s1
Igodo InChi
KJFUMXZZVYMQEU-AOCJBPQJSA-N
1 Aha ọzọ maka ihe a
Guanosin, 5′-O- [bis (4-methoxyphenyl) phenylmethyl] -2′-deoxy-2′ -fluoro-N(2-methyl-1-oxopropyl) -, 3'- [2-cyanoethyl bis (1-methyl ethyl) phosphoramite] (9CI)
Ngwongwo dị
Usoro ndu
Chemical
Lipinski
Ọdịdị metụtara
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Ihe kpatara bioconcentration | 298 | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 6350 | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 57800 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1,76 x 105 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 2.21 x 105 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 2,26 x 105 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 2,24 x 105 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 2.03 x 105 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 1.04 x 105 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ihe kpatara bioconcentration | 19300 | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Isi mmalite Ọnọdụ Uru Ala |
| Koc 312 pH 1; Okpomọkụ: 25 Celsius C (1) ACD |
| Koc 6630 pH 2; Okpomọkụ: 25 Celsius C (1) ACD |
| Koc 60400 pH 3; Okpomọkụ: 25 Celsius C (1) ACD |
| Koc 1.84 x 105 pH 4; Okpomọkụ: 25 Celsius C (1) ACD |
| Koc 2.31 x 105 pH 5; Okpomọkụ: 25 Celsius C (1) ACD |
| Koc 2.37 x 105 pH 6; Okpomọkụ: 25 Celsius C (1) ACD |
| Koc 2.35 x 105 pH 7; Okpomọkụ: 25 Celsius C (1) ACD |
| Koc 2.12 x 105 pH 8; Okpomọkụ: 25 Celsius C (1) ACD |
| Koc 1.08 x 105 pH 9; Okpomọkụ: 25 Celsius C (1) ACD |
| Koc 20200 pH 10; Okpomọkụ: 25 Celsius C (1) ACD |
| logD 4.47 pH 1; Okpomọkụ: 25 Celsius C (1) ACD |
| logD 5.80 pH 2; Okpomọkụ: 25 Celsius C (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| logD | 6.76 | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 7.24 | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 7.34 | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 7.35 | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 7.35 | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 7.30 | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 7.01 | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| logD | 6.28 | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| logP | 7.351±0.713 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ọkachamara Solubility dị n'ime | 3.0 x 10-5 g/L | Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 0.022 g/L | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.0 x 10-3 g/L | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 1.2 x 10-4 g/L | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.9 x 10-5 g/L | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.1 x 10-5 g/L | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.0 x 10-5 g/L | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.0 x 10-5 g/L | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.3 x 10-5 g/L | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 6.5 x 10-5 g/L | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.5 x 10-4 g/L | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| Uka Solubility | 3.0 x 10-5 g/L | Mmiri na-enweghị atụ pH 7.00; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility dị n'ime Molar | 3.5 x 10-8 mol / l | Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 2.6 x 10-5 mol / l | pH 1; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.2 x 10-6 mol / l | pH 2; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 1.4 x 10-7 mol / l | pH 3; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 4.5 x 10-8 mol / l | pH 4; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 3.6 x 10-8 mol/L | pH 5; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 3.5 x 10-8 mol / l | pH 6; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 3.5 x 10-8 mol / l | pH 7; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 3.9 x 10-8 mol/L | pH 8; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 7.6 x 10-8 mol/L | pH 9; Okpomọkụ: 25 Celsius C | (1) ACD |
| Solubility Molar | 4.1 x 10-7 mol/L | pH 10; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Solubility Molar | 3.5 x 10-8 mol / l | Mmiri na-enweghị atụ pH 7.00; Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 857.91 | ||
| pKa | 9.16±0.20 | Okpomọkụ kachasị acidic: 25 Celsius | (1) ACD |
| pKa | 3.45± 0.70 | Okpomọkụ kachasị mma: 25 Celsius | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ngwongwo | Uru | Isi mmalite ọnọdụ |
| Mpaghara elu elu | 184 A2 | (1) ACD |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ngwongwo | Uru | Ọnọdụ | Isi mmalite |
| Nkwekọrịta na-agbanwe agbanwe n'efu | 18 | (1) ACD | |
| H Ndị nnabata | 15 | (1) ACD | |
| H Ndị na-enye onyinye | 2 | (1) ACD | |
| H Donor/Anabata Nchikota | 17 | (1) ACD | |
| logP | 7.351±0.713 | Okpomọkụ: 25 Celsius C | (1) ACD |
| Ibu molekụla | 857.91 |
(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
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