(isoquinolin-1-yl)(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone
Chemical Structure Depiction of
(isoquinolin-1-yl)(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone
(isoquinolin-1-yl)(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone
Compound characteristics
| Compound ID: | T501-0433 |
| Compound Name: | (isoquinolin-1-yl)(3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)methanone |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C21 H25 N5 O |
| Smiles: | CC(C)n1cnnc1CC1CCCN(C1)C(c1c2ccccc2ccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5255 |
| logD: | 2.525 |
| logSw: | -2.6848 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.491 |
| InChI Key: | COXUGHREEGPAPO-MRXNPFEDSA-N |