N-phenyl-2-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyrrolidine-1-carboxamide
Chemical Structure Depiction of
N-phenyl-2-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyrrolidine-1-carboxamide
N-phenyl-2-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | S845-0298 |
| Compound Name: | N-phenyl-2-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyrrolidine-1-carboxamide |
| Molecular Weight: | 299.37 |
| Molecular Formula: | C16 H21 N5 O |
| Smiles: | CC(C)n1cnnc1C1CCCN1C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6957 |
| logD: | 1.6957 |
| logSw: | -2.0307 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.915 |
| InChI Key: | QOVKKQCBWCLKPE-AWEZNQCLSA-N |