4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}cyclohexane-1-carboxamide
4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | D757-0292 |
| Compound Name: | 4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}cyclohexane-1-carboxamide |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C25 H27 N5 O2 |
| Smiles: | C1C[C@@H](CC[C@H]1C(Nc1ccc(Cn2cncn2)cc1)=O)CN1Cc2ccccc2C1=O |
| Stereo: | ABSOLUTE |
| logP: | 2.7551 |
| logD: | 2.7551 |
| logSw: | -3.4869 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.145 |
| InChI Key: | SWQKUMGFHFRJHW-UHFFFAOYSA-N |