4-[4-(dimethylamino)phenyl]-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-(dimethylamino)phenyl]-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-(dimethylamino)phenyl]-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: | G281-0495 |
| Compound Name: | 4-[4-(dimethylamino)phenyl]-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: | 514.67 |
| Molecular Formula: | C30 H31 F N4 O S |
| Smiles: | CN(C)c1ccc(cc1)C1c2cccn2c2c(CN1C(NCc1ccc(cc1)F)=O)c1CCCCc1s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7454 |
| logD: | 6.732 |
| logSw: | -5.6086 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.0701 |
| InChI Key: | ORSRSTNLISFNFN-NDEPHWFRSA-N |