4-(3-chlorophenyl)-N-(2-methylpropyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Chemical Structure Depiction of
4-(3-chlorophenyl)-N-(2-methylpropyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
4-(3-chlorophenyl)-N-(2-methylpropyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | C800-0879 |
| Compound Name: | 4-(3-chlorophenyl)-N-(2-methylpropyl)-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 454.03 |
| Molecular Formula: | C25 H28 Cl N3 O S |
| Smiles: | CC(C)CNC(N1Cc2c3CCCCc3sc2n2cccc2C1c1cccc(c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.0086 |
| logD: | 7.0086 |
| logSw: | -6.3305 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.5369 |
| InChI Key: | JSJROPHMVRDPDV-HSZRJFAPSA-N |