3,3,7,8-tetramethyl-11-[4-(methylsulfanyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
3,3,7,8-tetramethyl-11-[4-(methylsulfanyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
3,3,7,8-tetramethyl-11-[4-(methylsulfanyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 8010-0899 |
| Compound Name: | 3,3,7,8-tetramethyl-11-[4-(methylsulfanyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 392.56 |
| Molecular Formula: | C24 H28 N2 O S |
| Smiles: | Cc1cc2c(cc1C)NC1CC(C)(C)CC(C=1C(c1ccc(cc1)SC)N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6242 |
| logD: | 5.6151 |
| logSw: | -5.461 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.748 |
| InChI Key: | BSMUCANIKIIEPV-QHCPKHFHSA-N |