11-(4-tert-butylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
Chemical Structure Depiction of
11-(4-tert-butylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
11-(4-tert-butylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one
Compound characteristics
| Compound ID: | 4151-0533 |
| Compound Name: | 11-(4-tert-butylphenyl)-5,11-dihydro-12H-benzo[b]indeno[1,2-e][1,4]thiazepin-12-one |
| Molecular Weight: | 397.54 |
| Molecular Formula: | C26 H23 N O S |
| Smiles: | CC(C)(C)c1ccc(cc1)C1C2=C(c3ccccc3C2=O)Nc2ccccc2S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.0468 |
| logD: | 7.0468 |
| logSw: | -5.7726 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.752 |
| InChI Key: | SCBCHAMADMBIGJ-RUZDIDTESA-N |