3,3-dimethyl-11-(4-methylphenyl)-10-{[2-(pyridin-3-yl)piperidin-1-yl]acetyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
3,3-dimethyl-11-(4-methylphenyl)-10-{[2-(pyridin-3-yl)piperidin-1-yl]acetyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
3,3-dimethyl-11-(4-methylphenyl)-10-{[2-(pyridin-3-yl)piperidin-1-yl]acetyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 8018-8481 |
| Compound Name: | 3,3-dimethyl-11-(4-methylphenyl)-10-{[2-(pyridin-3-yl)piperidin-1-yl]acetyl}-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 534.7 |
| Molecular Formula: | C34 H38 N4 O2 |
| Smiles: | Cc1ccc(cc1)C1C2=C(CC(C)(C)CC2=O)Nc2ccccc2N1C(CN1CCCCC1c1cccnc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1415 |
| logD: | 4.843 |
| logSw: | -4.6558 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.747 |
| InChI Key: | DFVFJGJCWKJBRM-UHFFFAOYSA-N |