11-(2,4,6-trimethylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
Chemical Structure Depiction of
11-(2,4,6-trimethylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
11-(2,4,6-trimethylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
Compound characteristics
| Compound ID: | Y020-5998 |
| Compound Name: | 11-(2,4,6-trimethylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one |
| Molecular Weight: | 383.51 |
| Molecular Formula: | C25 H21 N O S |
| Smiles: | Cc1cc(C)c(C2C3=C(c4ccccc4C3=O)Nc3ccccc3S2)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6413 |
| logD: | 6.6413 |
| logSw: | -5.6681 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.752 |
| InChI Key: | IRYJNMBNWJTBOD-RUZDIDTESA-N |