C33H35N3O8 Cytidine, N-acetyl-5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2'-O- methyl- (9CI, ACI)

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C33H35N3O8 Cytidine, N-acetyl-5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2'-O- methyl- (9CI, ACI)

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Faahfaahinta Alaabta

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Tilmaamaha jirka

Qalabka Jidhka ee Furaha ah Qiimaha Xaalad
Miisaanka Molecular 601.65 -
Cufnaanta (La saadaaliyay) 1.28± 0.1 g/cm3 Heerkulka: 20 °C;Riix: 760 Torr
pKa (La saadaaliyay) 10.19±0.20 Heerkulka ugu acidic badan: 25 °C

Magacyo Kale iyo Aqoonsiyo

Dhoola caddaynta O=C1N=C(C=CN1C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C=C5)C(O )C2OC)NC(=O)C
Isomeric SMILES C(OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O)N2C(=O)N=C(NC(C)=O)C =C2)(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChi
InChi=1S/C33H35N3O8/c1-21(37)34-28-18-19-36(32(39)35-28)31-30(42-4)29(38)27(44-31)20- 43-33(22-8-6-5-7-9-22,23-10-14-25(40-2) 15-11-23 13-24/h5-19,27,29-31,38H,20H2,1-4H3,(H,34,35,37,39)/t27-,29-,30-,31-/m1/s1
Furaha InChi
FINUHOJILDNELQ-PMFUCWTESA-N
1 Magaca kale ee walaxdan
N-Acetyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-methylcytidine (ACI)

Guryaha la saadaaliyay

Guryaha la heli karo
Nafley
Kiimiko
Cufnaanta
Lipinski
Qaab-dhismeedka La Xiriira

Nafley

Hanti Qiimaha Xaalad Xigasho
Qodobka bioconcentration 8.87 pH 1;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 27.8 pH 2;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 171 pH 3;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 515 pH 4;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 650 pH 5;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 668 pH 6;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 668 pH 7;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 657 pH 8;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 560 pH 9;Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 229 pH 10;Heerkulka: 25 °C (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Kiimiko

Hanti Qiimaha Xaalad Xigasho
Koc 48.6 pH 1;Heerkulka: 25 °C (1) ACD
Koc 152 pH 2;Heerkulka: 25 °C (1) ACD
Koc 935 pH 3;Heerkulka: 25 °C (1) ACD
Koc 2820 pH 4;Heerkulka: 25 °C (1) ACD
Koc 3560 pH 5;Heerkulka: 25 °C (1) ACD
Koc 3660 pH 6;Heerkulka: 25 °C (1) ACD
Koc 3660 pH 7;Heerkulka: 25 °C (1) ACD
Koc 3600 pH 8;Heerkulka: 25 °C (1) ACD
Koc 3070 pH 9;Heerkulka: 25 °C (1) ACD
Koc 1250 pH 10;Heerkulka: 25 °C (1) ACD
logD 2.14 pH 1;Heerkulka: 25 °C (1) ACD
logD 2.64 pH 2;Heerkulka: 25 °C (1) ACD

 

Hanti Qiimaha Xaalad Xigasho
logD 3.43 pH 3;Heerkulka: 25 °C (1) ACD
logD 3.91 pH 4;Heerkulka: 25 °C (1) ACD
logD 4.01 pH 5;Heerkulka: 25 °C (1) ACD
logD 4.02 pH 6;Heerkulka: 25 °C (1) ACD
logD 4.02 pH 7;Heerkulka: 25 °C (1) ACD
logD 4.01 pH 8;Heerkulka: 25 °C (1) ACD
logD 3.94 pH 9;Heerkulka: 25 °C (1) ACD
logD 3.55 pH 10;Heerkulka: 25 °C (1) ACD
logP 4.021± 0.768 Heerkulka: 25 °C (1) ACD
Solubility Mass Intrinsic 1.3 x 10-3 g/L Heerkulka: 25 °C (1) ACD
Xalka tirada badan 0.10 g/L pH 1;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 0.032 g/L pH 2;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 5.2 x 10-3 g/L pH 3;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 1.7 x 10-3 g/L pH 4;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 1.4 x 10-3 g/L pH 5;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 1.3 x 10-3 g/L pH 6;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 1.3 x 10-3 g/L pH 7;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 1.3 x 10-3 g/L pH 8;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 1.6 x 10-3 g/L pH 9;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 3.9 x 10-3 g/L pH 10;Heerkulka: 25 °C (1) ACD
Xalka tirada badan 1.3 x 10-3 g/L Biyaha aan la daboolin pH 6.99;Heerkulka: 25 °C (1) ACD
Solubility Intrinsic Molar 2.2 x 10-6 mol/L Heerkulka: 25 °C (1) ACD
Solubility Molar 1.7 x 10-4 mol/L pH 1;Heerkulka: 25 °C (1) ACD
Solubility Molar 5.3 x 10-5 mol/L pH 2;Heerkulka: 25 °C (1) ACD
Solubility Molar 8.6 x 10-6 mol/L pH 3;Heerkulka: 25 °C (1) ACD
Solubility Molar 2.9 x 10-6 mol/L pH 4;Heerkulka: 25 °C (1) ACD
Solubility Molar 2.3 x 10-6 mol/L pH 5;Heerkulka: 25 °C (1) ACD
Solubility Molar 2.2 x 10-6 mol/L pH 6;Heerkulka: 25 °C (1) ACD
Solubility Molar 2.2 x 10-6 mol/L pH 7;Heerkulka: 25 °C (1) ACD
Solubility Molar 2.2 x 10-6 mol/L pH 8;Heerkulka: 25 °C (1) ACD
Solubility Molar 2.6 x 10-6 mol/L pH 9;Heerkulka: 25 °C (1) ACD
Solubility Molar 6.4 x 10-6 mol/L pH 10;Heerkulka: 25 °C (1) ACD

 

Hanti Qiimaha Xaalad Xigasho
Solubility Molar 2.2 x 10-6 mol/L Biyaha aan la daboolin pH 6.99;Heerkulka: 25 °C (1) ACD
Miisaanka Molecular 601.65    
pKa 10.19±0.20 Heerkulka ugu acidic badan: 25 °C (1) ACD
pKa 3.57±0.20 Heerkulka ugu badan ee aasaasiga ah: 25 °C (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Cufnaanta

Hanti Qiimaha Xaalad Xigasho
Cufnaanta 1.28± 0.1 g/cm3 Heerkulka: 20 °C;Riix: 760 Torr (1) ACD
Mugga Molar 466.5 ± 7.0 cm3 / mol Heerkulka: 20 °C;Riix: 760 Torr (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Hanti Qiimaha Xaalad Xigasho
Boondhigyo si xor ah loo wareejin karo 11   (1) ACD
H Aqbalayaasha 11   (1) ACD
H Deeq-bixiyayaasha 2   (1) ACD
Ku-deeqaha/Aqbalka Wadarta 13   (1) ACD
logP 4.021± 0.768 Heerkulka: 25 °C (1) ACD
Miisaanka Molecular 601.65    

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Qaab-dhismeedka La Xiriira

Hanti Qiimaha

Xaalad

Xigasho
Aagga dusha sare ee Polar 128 A2 (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Spectra la saadaaliyay

Spectra waa la heli karaa
1H NMR
13C NMR


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