C39H37N5o7 Adenosine, N-Benzoyyl-5'-O- [BIS (4-Movhyphenyl) phenylmethenys
| Fananana ara-batana lehibe | sarobidy | toe-javatra |
| Lanjan'ny molekiola | 687.74 | - |
| Fahalemena (nambara) | 1.32 ± 0.1 g / cm3 | Temp: 20 ° C; Press: 760 Torr |
| PKA (nambara) | 7.87 ± 0.43 | Ankamaroan'ny temps temp: 25 ° C |
Kanonical smiles o = c (NC1 = NC = NC2 = CN2C3OC (COC (C = 4C = CC = C (OC) C = C (OC) C = C (O) C (O) C3OC) C = 7C = CC = CC7
Mitsiky i Isomeric
C (OC [C @ @ H] 1o [C @ h] ([OC) (OC) [C @@ H] C7 = CC = CC = C7
Inchi
Inchi = 1s / c39h37n5o7 / c1-47-29-18-14-29 (15-19-29) 39 (26-12-8-5-9-13-26,0 (48-20-30 (48-2) 21-17-28) 50-22-31-33 (45) 34 (49-3) 38 (51 31) 44-24-42-36 (32-23-41-36 (32-24-41-36 (32) 44) 43-37 (46) 25-10-6-4-7-11-25 / H4-25 / H4-21,23-24,31,33-34,38343, 22h2,138
34-, 38- / M1 / S1
Inchi Key
Sarhdaqoznkzcc-cjegosrcsa-n
1 anarana hafa ho an'ity akora ity
N-benzoyyl-5'-O- [BIS (4-metoxyphenyl) phenylmetheryl] -2'--o-methyladenosine (Aci)
Spectra misy
1H NMR
13c NMR
-bahoaka
Fananana misy
niteraka
simika
hakitroky
Lipinski
Mifandraika mifandraika
niteraka
| NY FANANANA | sarobidy | toe-javatra | Source |
| Factor Bioconcentration | 47800 | PH 1; Temp: 25 ° C | (1) ACD |
| Factor Bioconcentration | 1.63 x 105 | PH 2; Temp: 25 ° C | (1) ACD |
| Factor Bioconcentration | 2.16 x 105 | PH 3; Temp: 25 ° C | (1) ACD |
| Factor Bioconcentration | 2.23 x 105 | PH 4; Temp: 25 ° C | (1) ACD |
| Factor Bioconcentration | 2.23 x 105 | PH 5; Temp: 25 ° C | (1) ACD |
| Factor Bioconcentration | 2.18 x 105 | PH 6; Temp: 25 ° C | (1) ACD |
| Factor Bioconcentration | 1.79 x 105 | PH 7; Temp: 25 ° C | (1) ACD |
| Factor Bioconcentration | 64900 | PH 8; Temp: 25 ° C | (1) ACD |
| Factor Bioconcentration | 10600 | PH 9; Temp: 25 ° C | (1) ACD |
| Factor Bioconcentration | 3110 | PH 10; Temp: 25 ° C | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
simika
| NY FANANANA | sarobidy | toe-javatra | Source |
| Koc | 50200 | PH 1; Temp: 25 ° C | (1) ACD |
| Koc | 1.71 x 105 | PH 2; Temp: 25 ° C | (1) ACD |
| Koc | 2.26 x 105 | PH 3; Temp: 25 ° C | (1) ACD |
| Koc | 2.34 x 105 | PH 4; Temp: 25 ° C | (1) ACD |
| Koc | 2.34 x 105 | PH 5; Temp: 25 ° C | (1) ACD |
| Koc | 2.29 x 105 | PH 6; Temp: 25 ° C | (1) ACD |
| Koc | 1.88 x 105 | PH 7; Temp: 25 ° C | (1) ACD |
| NY FANANANA | sarobidy | toe-javatra | Source |
| Koc | 68000 | PH 8; Temp: 25 ° C | (1) ACD |
| Koc | 11200 | PH 9; Temp: 25 ° C | (1) ACD |
| Koc | 3260 | PH 10; Temp: 25 ° C | (1) ACD |
| LogD | 6.67 | PH 1; Temp: 25 ° C | (1) ACD |
| LogD | 7.21 | PH 2; Temp: 25 ° C | (1) ACD |
| LogD | 7.33 | PH 3; Temp: 25 ° C | (1) ACD |
| LogD | 7.34 | PH 4; Temp: 25 ° C | (1) ACD |
| LogD | 7.34 | PH 5; Temp: 25 ° C | (1) ACD |
| LogD | 7.33 | PH 6; Temp: 25 ° C | (1) ACD |
| LogD | 7.25 | PH 7; Temp: 25 ° C | (1) ACD |
| LogD | 6.80 | PH 8; Temp: 25 ° C | (1) ACD |
| LogD | 6.02 | PH 9; Temp: 25 ° C | (1) ACD |
| LogD | 5.49 | PH 10; Temp: 25 ° C | (1) ACD |
| Logp | 7.344 ± 0.723 | Temp: 25 ° C | (1) ACD |
| Solondrailala an-tsokosoko | 2.7 x 10-6 g / l | Temp: 25 ° C | (1) ACD |
| Supubility Mass | 1.2 x 10-5 g / l | PH 1; Temp: 25 ° C | (1) ACD |
| Supubility Mass | 3.7 x 10-6 g / l | PH 2; Temp: 25 ° C | (1) ACD |
| Supubility Mass | 2.8 x 10-6 g / l | PH 3; Temp: 25 ° C | (1) ACD |
| Supubility Mass | 2.8 x 10-6 g / l | PH 4; Temp: 25 ° C | (1) ACD |
| Supubility Mass | 2.8 x 10-6 g / l | PH 5; Temp: 25 ° C | (1) ACD |
| Supubility Mass | 2.8 x 10-6 g / l | PH 6; Temp: 25 ° C | (1) ACD |
| Supubility Mass | 3.4 x 10-6 g / l | PH 7; Temp: 25 ° C | (1) ACD |
| Supubility Mass | 9.6 x 10-6 g / l | PH 8; Temp: 25 ° C | (1) ACD |
| Supubility Mass | 5.7 x 10-5 g / l | PH 9; Temp: 25 ° C | (1) ACD |
| Supubility Mass | 1.9 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
| Supubility Mass | 3.4 x 10-6 g / l | PH 7 7,00; Temp: 25 ° C | (1) ACD |
| Movra intrinsic solubility | 3.9 x 10-9 Mol / l | Temp: 25 ° C | (1) ACD |
| Molar Solubility | 1.8 x 10-8 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
| Molar Solubility | 5.4 x 10-9 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
| Molar Solubility | 4.1 x 10-9 mol / l | PH 3; Temp: 25 ° C | (1) ACD |
| Molar Solubility | 4.0 x 10-9 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
| Molar Solubility | 4.0 x 10-9 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
| NY FANANANA | sarobidy | toe-javatra | Source |
| Molar Solubility | 4.0 x 10-9 mol / l | PH 6; Temp: 25 ° C | (1) ACD |
| Molar Solubility | 4.9 x 10-9 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
| Molar Solubility | 1.4 x 10-8 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
| Molar Solubility | 8.3 x 10-8 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
| Molar Solubility | 2.8 x 10-7 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
| Molar Solubility | 4.9 x 10-9 mol / l | PH 7 7,00; Temp: 25 ° C | (1) ACD |
| Lanjan'ny molekiola | 687.74 | ||
| pka | 7.87 ± 0.43 | Ankamaroan'ny temps temp: 25 ° C | (1) ACD |
| pka | 1.39 ± 0.10 | Ny ankamaroan'ny Temp: 25 ° C | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
hakitroky
| NY FANANANA | sarobidy | toe-javatra | Source |
| hakitroky | 1.32 ± 0.1 g / cm3 | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
| Molar volume | 518.5 ± 7.0 cm3 / mol | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
Lipinski
| NY FANANANA | sarobidy | toe-javatra | Source |
| Fatorana rotatateble malalaka | 12 | (1) ACD | |
| H Mpanaja | 12 | (1) ACD | |
| H mpamatsy vola | 2 | (1) ACD | |
| H Donor / Accas Sum | 14 | (1) ACD | |
| Logp | 7.344 ± 0.723 | Temp: 25 ° C | (1) ACD |
| Lanjan'ny molekiola | 687.74 |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
Mifandraika mifandraika
| NY FANANANA | sarobidy | toe-javatra | Source |
| Faritra misy polar | 139 A2 | (1) ACD | |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
Spectra misy
1H NMR
Spectra misy
13c NMR
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