4-(3,4-dimethoxyphenyl)-N-propyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
4-(3,4-dimethoxyphenyl)-N-propyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
4-(3,4-dimethoxyphenyl)-N-propyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
Compound ID: | G118-1531 |
Compound Name: | 4-(3,4-dimethoxyphenyl)-N-propyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
Molecular Weight: | 405.5 |
Molecular Formula: | C24 H27 N3 O3 |
Smiles: | CCCNC(N1Cc2ccccc2n2cccc2C1c1ccc(c(c1)OC)OC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8944 |
logD: | 4.8944 |
logSw: | -4.5319 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 43.267 |
InChI Key: | ZQHKPPWOEJPXOU-HSZRJFAPSA-N |