11-{4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl}-3-phenyl-10-(thiophene-2-carbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-{4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl}-3-phenyl-10-(thiophene-2-carbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-{4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl}-3-phenyl-10-(thiophene-2-carbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 8012-4667 |
| Compound Name: | 11-{4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl}-3-phenyl-10-(thiophene-2-carbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 661.22 |
| Molecular Formula: | C39 H33 Cl N2 O4 S |
| Smiles: | CCOc1cc(ccc1OCc1ccc(cc1)[Cl])C1C2=C(CC(CC2=O)c2ccccc2)Nc2ccccc2N1C(c1cccs1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 8.6171 |
| logD: | 8.5731 |
| logSw: | -6.456 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.436 |
| InChI Key: | GEGDYHYQKVHQKW-UHFFFAOYSA-N |