C31H32N2O8 Uridine, 5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2'-O-methyl- (9C I, ACI)

ngwaahịa

C31H32N2O8 Uridine, 5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2'-O-methyl- (9C I, ACI)

Ozi bụ isi:


Nkọwa ngwaahịa

Mkpado ngwaahịa

Njirimara anụ ahụ

Njirimara anụ ahụ igodo Uru Ọnọdụ
Ibu molekụla 560.60 -
Njupụta (buru amụma) 1.35±0.1 g/cm3 Okpomọkụ: 20 °C; Pịa: 760 Torr
pKa (buru amụma) 9.39±0.10 Okpomọkụ kachasị acidic: 25 Celsius

Aha ndị ọzọ na njirimara

Canonical SILES O=C1C=CN(C(=O)N1)C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C= C5)C(O)C2OC
Isomeric SMILES C (OC[C@H] 1O[C@H]([C@H](OC)[C@@H] 1O) N2C(=O)NC(=O)C=C2)(C3= CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChi
InChi=1S/C31H32N2O8/c1-37-23-13-9-21(10-14-23)31(20-7-5-4-6-8) -20,22-11-15-24(38-2)16-12-22)40-19-25-27(35)28(39-3)29(41-25)
33-18-17-26(34)32-30(33)36/h4-18,25,27-29,35H,19H2,1-3H3,(H,32,34,36)/t25-,27 -,28-,29-/m1/s1
Igodo InChi
MFDHAVFJDSRPKC-YXINZVNLSA-N
2 Aha ndị ọzọ maka ihe a
5′-O-[Bis (4-methoxyphenyl) phenylmethyl] -2′-O-methyluridine (ACI); 5'-O- (4,4'-Dimethoxytril) -2'-O-methyluridine

Spectra nnwale

Spectra dị
1H NMR
Mass

Njirimara amụma

Ngwongwo dị
Usoro ndu
Chemical
Njupụta
Lipinski
Ọdịdị metụtara

Usoro ndu

Ngwongwo Uru Ọnọdụ Isi mmalite
Ihe kpatara bioconcentration 1240 pH 1; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 1240 pH 2; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 1240 pH 3; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 1240 pH 4; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 1240 pH 5; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 1240 pH 6; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 1230 pH 7; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 1190 pH 8; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 861 pH 9; Okpomọkụ: 25 Celsius C (1) ACD
Ihe kpatara bioconcentration 238 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)

Chemical

Ngwongwo Uru Ọnọdụ Isi mmalite
Koc 5690 pH 1; Okpomọkụ: 25 Celsius C (1) ACD
Koc 5690 pH 2; Okpomọkụ: 25 Celsius C (1) ACD
Koc 5690 pH 3; Okpomọkụ: 25 Celsius C (1) ACD
Koc 5690 pH 4; Okpomọkụ: 25 Celsius C (1) ACD
Koc 5690 pH 5; Okpomọkụ: 25 Celsius C (1) ACD
Koc 5690 pH 6; Okpomọkụ: 25 Celsius C (1) ACD
Koc 5670 pH 7; Okpomọkụ: 25 Celsius C (1) ACD
Koc 5450 pH 8; Okpomọkụ: 25 Celsius C (1) ACD

 

Ngwongwo Uru Ọnọdụ Isi mmalite
Koc 3960 pH 9; Okpomọkụ: 25 Celsius C (1) ACD
Koc 1100 pH 10; Okpomọkụ: 25 Celsius C (1) ACD
logD 4.37 pH 1; Okpomọkụ: 25 Celsius C (1) ACD
logD 4.37 pH 2; Okpomọkụ: 25 Celsius C (1) ACD
logD 4.37 pH 3; Okpomọkụ: 25 Celsius C (1) ACD
logD 4.37 pH 4; Okpomọkụ: 25 Celsius C (1) ACD
logD 4.37 pH 5; Okpomọkụ: 25 Celsius C (1) ACD
logD 4.37 pH 6; Okpomọkụ: 25 Celsius C (1) ACD
logD 4.37 pH 7; Okpomọkụ: 25 Celsius C (1) ACD
logD 4.35 pH 8; Okpomọkụ: 25 Celsius C (1) ACD
logD 4.21 pH 9; Okpomọkụ: 25 Celsius C (1) ACD
logD 3.66 pH 10; Okpomọkụ: 25 Celsius C (1) ACD
logP 4.372±0.582 Okpomọkụ: 25 Celsius C (1) ACD
Ọkachamara Solubility dị n'ime 3.7 x 10-4 g/L Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 3.7 x 10-4 g/L pH 1; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 3.7 x 10-4 g/L pH 2; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 3.7 x 10-4 g/L pH 3; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 3.7 x 10-4 g/L pH 4; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 3.7 x 10-4 g/L pH 5; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 3.7 x 10-4 g/L pH 6; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 3.7 x 10-4 g/L pH 7; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 3.8 x 10-4 g/L pH 8; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 5.3 x 10-4 g/L pH 9; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 1.9 x 10-3 g/L pH 10; Okpomọkụ: 25 Celsius C (1) ACD
Uka Solubility 3.7 x 10-4 g/L Mmiri na-enweghị atụ pH 6.99; Okpomọkụ: 25 Celsius C (1) ACD
Solubility dị n'ime Molar 6.6 x 10-7 mol/L Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 6.6 x 10-7 mol/L pH 1; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 6.6 x 10-7 mol/L pH 2; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 6.6 x 10-7 mol/L pH 3; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 6.6 x 10-7 mol/L pH 4; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 6.6 x 10-7 mol/L pH 5; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 6.6 x 10-7 mol/L pH 6; Okpomọkụ: 25 Celsius C (1) ACD

 

Ngwongwo Uru Ọnọdụ Isi mmalite
Solubility Molar 6.6 x 10-7 mol/L pH 7; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 6.8 x 10-7 mol/L pH 8; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 9.4 x 10-7 mol/L pH 9; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 3.4 x 10-6 mol/L pH 10; Okpomọkụ: 25 Celsius C (1) ACD
Solubility Molar 6.6 x 10-7 mol/L Mmiri na-enweghị atụ pH 6.99; Okpomọkụ: 25 Celsius C (1) ACD
Ibu molekụla 560.60    
pKa 9.39±0.10 Okpomọkụ kachasị acidic: 25 Celsius (1) ACD

(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Njupụta

Ngwongwo Uru Ọnọdụ Isi mmalite
Njupụta 1.35±0.1 g/cm3 Okpomọkụ: 20 °C; Pịa: 760 Torr (1) ACD
Olu Molar 412.9±5.0 cm3/mol Okpomọkụ: 20 °C; Pịa: 760 Torr (1) ACD

(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Ngwongwo Uru Ọnọdụ Isi mmalite
Nkwekọrịta na-agbanwe agbanwe n'efu 11   (1) ACD
H Ndị nnabata 10   (1) ACD
H Ndị na-enye onyinye 2   (1) ACD
H Donor/Anabata Nchikota 12   (1) ACD
logP 4.372±0.582 Okpomọkụ: 25 Celsius C (1) ACD
Ibu molekụla 560.60    

(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Ọdịdị metụtara

Ngwongwo Uru

Ọnọdụ

Isi mmalite
Mpaghara elu elu 116 A2 (1) ACD

(1) Gbakọọ site na iji Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Spectra buru amụma

Spectra dị
1H NMR
13C NMR


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