4-(4-chlorophenyl)-N-[(4-fluorophenyl)methyl]-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-(4-chlorophenyl)-N-[(4-fluorophenyl)methyl]-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
4-(4-chlorophenyl)-N-[(4-fluorophenyl)methyl]-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: | G281-0080 |
| Compound Name: | 4-(4-chlorophenyl)-N-[(4-fluorophenyl)methyl]-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 506.04 |
| Molecular Formula: | C28 H25 Cl F N3 O S |
| Smiles: | C1CCc2c(C1)c1CN(C(c3ccc(cc3)[Cl])c3cccn3c1s2)C(NCc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2501 |
| logD: | 7.2501 |
| logSw: | -6.7405 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.2654 |
| InChI Key: | MHMXIGYVXUIEPY-AREMUKBSSA-N |