C39H37N5O7 Adenosine, N-Benzoyl-5'-O - [Metoxyyl-5'e feniLmetil] -2'- medi = metil-metil- (9ci, ACI)
Asosiy jismoniy xususiyatlar | Qiymati | Shart |
Molekulyar og'irlik | 687.74 | - |
Zichlik (bashorat qilingan) | 1.32 ± g / sm3 | Temp: 20 ° C; Matbuot: 760 tor |
PKA (bashorat qilingan) | 7.87 ± 0.43 | Aksariyat kislotali temp: 25 ° C |
Canonik tabassum o = c (nc1 = nc2 = cn2c3oc (CC) C C = C6) c (OC) c6) c = 7c = cc7
Izomerik tabassumlar
C (OC [C @ H] ([C @ O] (C5 = C2) c4 = C5c = C4) c4 = c4 c4) (C5 = CC = C4) c7 = cc = cc = c7
Kelini
InChI=1S/C39H37N5O7/c1-47-29-18-14-27(15-19-29)39(26-12-8-5-9-13-26,28-16-20-30(48-2)21-17-28)50-22-31-33(45)34(49-3)38(51- 31) 44-24-42-32-35 (40-23-41-36 (32) 44) 25-10-6-7-24,33-34,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45,45 gacha) / T31-, 33-,
34-, 38- / m1 / s1
Inchi tugmachasi
Sarhdayaqoznkzcc-Cjegosrit-n
1 Ushbu modda uchun boshqa ism
N-Benzoyl-5'-O - [Bis (4-metvoksilind) -2'-o-meksilladarenozine (ACI)
Spektr mavjud
1H nmr
NMR nmr
Massa
Xususiyatlar mavjud
Biologik
Kimyoviy
Zichlik
Litski
Tuzilishi bilan bog'liq
Biologik
Mulk | Qiymati | Shart | Manba |
Bioconterstratsion omil | 47800 | PH 1; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1.63 x 105 | PH 2; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 2.16 x 105 | pH 3; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 2.23 x 105 | PH 4; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 2.23 x 105 | PH 5; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 2.18 x 105 | pH 6; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1.79 x 105 | PH 7; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 64900 | PH 8; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 10600 | PH 9; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 3110 | PH 10; Temp: 25 ° C | (1) ACD |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
Kimyoviy
Mulk | Qiymati | Shart | Manba |
Koc | 50200 yil | 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 |
Mulk | Qiymati | Shart | Manba |
Koc | 68000 | PH 8; Temp: 25 ° C | (1) ACD |
Koc | 11200 yil | 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 |
Ommaviy eriylik | 2.7 x 10-6 g / l | Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 1.2 x 10-5 g / l | PH 1; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 3.7 x 10-6 g / l | PH 2; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 2.8 x 10-6 g / l | pH 3; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 2.8 x 10-6 g / l | PH 4; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 2.8 x 10-6 g / l | PH 5; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 2.8 x 10-6 g / l | pH 6; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 3.4 x 10-6 g / l | PH 7; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 9.6 x 10-6 g / l | PH 8; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.7 x 10-5 g / l | PH 9; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 1.9 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 3.4 x 10-6 g / l | Neytral suv pH 7.00; Temp: 25 ° C | (1) ACD |
Molyar ichidagi eriylik | 3.9 x 10-9 mol / l | Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.8 x 10-8 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 5.4 x 10-9 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 4.1 x 10-9 mol / l | pH 3; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 4.0 x 10-9 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 4.0 x 10-9 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
Mulk | Qiymati | Shart | Manba |
Molyar eriylik | 4.0 x 10-9 mol / l | pH 6; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 4.9 x 10-9 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.4 x 10-8 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 8.3 x 10-8 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 2.8 x 10-7 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 4.9 x 10-9 mol / l | Neytral suv pH 7.00; Temp: 25 ° C | (1) ACD |
Molekulyar og'irlik | 687.74 | ||
pka | 7.87 ± 0.43 | Aksariyat kislotali temp: 25 ° C | (1) ACD |
pka | 1.39 ± 0.10 | Eng asosiy temp: 25 ° C | (1) ACD |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
Zichlik
Mulk | Qiymati | Shart | Manba |
Zichlik | 1.32 ± g / sm3 | Temp: 20 ° C; Matbuot: 760 tor | (1) ACD |
Molyar hajmi | 518.5 ± 7.0 sm3 / mol | Temp: 20 ° C; Matbuot: 760 tor | (1) ACD |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
Litski
Mulk | Qiymati | Shart | Manba |
Erkin aylanadigan aloqalar | 12 | (1) ACD | |
H maqolalari | 12 | (1) ACD | |
H donorlar | 2 | (1) ACD | |
H donor / qabul summasi | 14 | (1) ACD | |
logp | 7.344 ± 0.723 | Temp: 25 ° C | (1) ACD |
Molekulyar og'irlik | 687.74 |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
Tuzilishi bilan bog'liq
Mulk | Qiymati | Shart | Manba |
Polar sirt maydoni | 139 A2 | (1) ACD |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
Spektr mavjud
1H nmr
Spektr mavjud
NMR nmr