3-(4-chlorophenyl)-11-[4-(dimethylamino)phenyl]-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-11-[4-(dimethylamino)phenyl]-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
3-(4-chlorophenyl)-11-[4-(dimethylamino)phenyl]-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 4038-0031 |
| Compound Name: | 3-(4-chlorophenyl)-11-[4-(dimethylamino)phenyl]-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 500.04 |
| Molecular Formula: | C30 H30 Cl N3 O2 |
| Smiles: | CCC(N1C(C2=C(CC(CC2=O)c2ccc(cc2)[Cl])Nc2ccccc12)c1ccc(cc1)N(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.4584 |
| logD: | 6.1386 |
| logSw: | -6.4518 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.442 |
| InChI Key: | HDPIVSMPIGAEOR-UHFFFAOYSA-N |