N-{1-[(4-cyanophenyl)methyl]piperidin-4-yl}-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-{1-[(4-cyanophenyl)methyl]piperidin-4-yl}-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
N-{1-[(4-cyanophenyl)methyl]piperidin-4-yl}-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | D757-0263 |
| Compound Name: | N-{1-[(4-cyanophenyl)methyl]piperidin-4-yl}-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 470.61 |
| Molecular Formula: | C29 H34 N4 O2 |
| Smiles: | C1CN(CCC1NC([C@H]1CC[C@@H](CC1)CN1Cc2ccccc2C1=O)=O)Cc1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6082 |
| logD: | 2.5222 |
| logSw: | -3.6657 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.812 |
| InChI Key: | CSTKGDBSUOCFPU-UHFFFAOYSA-N |