11-[4-(methylsulfanyl)phenyl]-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
Chemical Structure Depiction of
11-[4-(methylsulfanyl)phenyl]-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
11-[4-(methylsulfanyl)phenyl]-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
Compound characteristics
| Compound ID: | 8016-0556 |
| Compound Name: | 11-[4-(methylsulfanyl)phenyl]-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one |
| Molecular Weight: | 387.52 |
| Molecular Formula: | C23 H17 N O S2 |
| Smiles: | CSc1ccc(cc1)C1C2=C(c3ccccc3C2=O)Nc2ccccc2S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9716 |
| logD: | 5.9716 |
| logSw: | -5.6558 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.752 |
| InChI Key: | LPEGACJKSZRARZ-HSZRJFAPSA-N |