N-(2-chloro-4-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
N-(2-chloro-4-methylphenyl)-1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
N-(2-chloro-4-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: | J024-0307 |
Compound Name: | N-(2-chloro-4-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: | 463.98 |
Molecular Formula: | C25 H22 Cl N3 O2 S |
Smiles: | Cc1ccc(c(c1)[Cl])NC(N1C(C2=C(CCCC2=O)Nc2ccccc12)c1cccs1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.1122 |
logD: | 6.0497 |
logSw: | -6.0229 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 48.306 |
InChI Key: | UBRILRKNLKYXEU-DEOSSOPVSA-N |