4-(4-chlorophenyl)-9-methyl-N-(3-methylbutyl)-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Chemical Structure Depiction of
4-(4-chlorophenyl)-9-methyl-N-(3-methylbutyl)-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
4-(4-chlorophenyl)-9-methyl-N-(3-methylbutyl)-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G281-1940 |
| Compound Name: | 4-(4-chlorophenyl)-9-methyl-N-(3-methylbutyl)-7,8,9,10-tetrahydro-4H-pyrido[4',3':4,5]thieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 483.08 |
| Molecular Formula: | C26 H31 Cl N4 O S |
| Smiles: | CC(C)CCNC(N1Cc2c3CCN(C)Cc3sc2n2cccc2C1c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3803 |
| logD: | 4.6164 |
| logSw: | -6.4421 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.788 |
| InChI Key: | DICBSWQELCUFTK-XMMPIXPASA-N |