11-(furan-2-yl)-N-[3-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
Chemical Structure Depiction of
11-(furan-2-yl)-N-[3-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
11-(furan-2-yl)-N-[3-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
Compound characteristics
| Compound ID: | J024-0835 |
| Compound Name: | 11-(furan-2-yl)-N-[3-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C25 H23 N3 O3 S |
| Smiles: | CSc1cccc(c1)NC(N1C(C2=C(CCCC2=O)Nc2ccccc12)c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.03 |
| logD: | 4.9675 |
| logSw: | -4.6599 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.564 |
| InChI Key: | RAKVWSBFRPGOKR-DEOSSOPVSA-N |