11-[4-(methylsulfanyl)phenyl]-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol
Chemical Structure Depiction of
11-[4-(methylsulfanyl)phenyl]-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol
11-[4-(methylsulfanyl)phenyl]-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol
Compound characteristics
| Compound ID: | C472-0049 |
| Compound Name: | 11-[4-(methylsulfanyl)phenyl]-11H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-ol |
| Molecular Weight: | 387.52 |
| Molecular Formula: | C23 H17 N O S2 |
| Smiles: | CSc1ccc(cc1)C1C2=C(c3ccccc3C2=Nc2ccccc2S1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3642 |
| logD: | 4.0424 |
| logSw: | -5.4716 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.9064 |
| InChI Key: | BWNOVAFNPFVNDE-HSZRJFAPSA-N |