N-(2,5-difluorophenyl)-4-[4-(methylsulfanyl)phenyl]-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
N-(2,5-difluorophenyl)-4-[4-(methylsulfanyl)phenyl]-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
N-(2,5-difluorophenyl)-4-[4-(methylsulfanyl)phenyl]-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: | G281-0297 |
| Compound Name: | N-(2,5-difluorophenyl)-4-[4-(methylsulfanyl)phenyl]-7,8,9,10-tetrahydro-4H-[1]benzothieno[3,2-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 521.65 |
| Molecular Formula: | C28 H25 F2 N3 O S2 |
| Smiles: | CSc1ccc(cc1)C1c2cccn2c2c(CN1C(Nc1cc(ccc1F)F)=O)c1CCCCc1s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.1464 |
| logD: | 8.1463 |
| logSw: | -5.6656 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.2455 |
| InChI Key: | KOMGLPXRZZDPQT-SANMLTNESA-N |