81996-15-8 ((1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-)

CAS号:
81996-15-8
英文名称:
1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-
分子式:
C20H26N6O2
分子量:
382.459443569183

1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-(81996-15-8)名称与标识符

名称

英文别名:
1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-;1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-;

标识符

InChIKey:
LQBTWYFXNACJTO-UHFFFAOYSA-N
Inchi:
1S/C20H26N6O2/c1-15-5-4-6-16(13-15)25-10-7-24(8-11-25)9-12-26-14-21-18-17(26)19(27)23(3)20(28)22(18)2/h4-6,13-14H,7-12H2,1-3H3
SMILES:
N1(CCN2CCN(C3=CC=CC(C)=C3)CC2)C2=C(N(C)C(=O)N(C)C2=O)N=C1

1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-(81996-15-8)物化性质

实验特性

  • 沸点 : 626.4±65.0 °C(Predicted)
  • 酸度系数(pKa) : 6.77±0.10(Predicted)
  • 密度 : 1.31±0.1 g/cm3(Predicted)