11-(2,5-dimethylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
Chemical Structure Depiction of
11-(2,5-dimethylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
11-(2,5-dimethylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
Compound characteristics
| Compound ID: | Y020-6001 |
| Compound Name: | 11-(2,5-dimethylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one |
| Molecular Weight: | 369.48 |
| Molecular Formula: | C24 H19 N O S |
| Smiles: | Cc1ccc(C)c(c1)C1C2=C(c3ccccc3C2=O)Nc2ccccc2S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1446 |
| logD: | 6.1446 |
| logSw: | -5.4875 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.752 |
| InChI Key: | WAAKIUOVCOUORW-XMMPIXPASA-N |