3,3-dimethyl-N-(2-methylphenyl)-1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
Chemical Structure Depiction of
3,3-dimethyl-N-(2-methylphenyl)-1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
3,3-dimethyl-N-(2-methylphenyl)-1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
Compound characteristics
| Compound ID: | J024-0264 |
| Compound Name: | 3,3-dimethyl-N-(2-methylphenyl)-1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide |
| Molecular Weight: | 457.59 |
| Molecular Formula: | C27 H27 N3 O2 S |
| Smiles: | Cc1ccccc1NC(N1C(C2=C(CC(C)(C)CC2=O)Nc2ccccc12)c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7887 |
| logD: | 5.6486 |
| logSw: | -5.4965 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.306 |
| InChI Key: | YICYIGIBVDMSSG-VWLOTQADSA-N |