10-acetyl-3-(4-chlorophenyl)-11-{4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-acetyl-3-(4-chlorophenyl)-11-{4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-acetyl-3-(4-chlorophenyl)-11-{4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 8012-4699 |
| Compound Name: | 10-acetyl-3-(4-chlorophenyl)-11-{4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 627.57 |
| Molecular Formula: | C36 H32 Cl2 N2 O4 |
| Smiles: | CCOc1cc(ccc1OCc1ccc(cc1)[Cl])C1C2=C(CC(CC2=O)c2ccc(cc2)[Cl])Nc2ccccc2N1C(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.7554 |
| logD: | 7.4356 |
| logSw: | -6.4159 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.157 |
| InChI Key: | DIGWGDPLQSYITM-UHFFFAOYSA-N |