5-cyclopropyl-2-methyl-4-{1-[(pyridin-4-yl)methyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-cyclopropyl-2-methyl-4-{1-[(pyridin-4-yl)methyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one
5-cyclopropyl-2-methyl-4-{1-[(pyridin-4-yl)methyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0531 |
| Compound Name: | 5-cyclopropyl-2-methyl-4-{1-[(pyridin-4-yl)methyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 313.4 |
| Molecular Formula: | C17 H23 N5 O |
| Smiles: | CN1C(N(C2CCN(CC2)Cc2ccncc2)C(C2CC2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6681 |
| logD: | 1.4388 |
| logSw: | -1.5059 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.81 |
| InChI Key: | WYLLHDICRLZUIP-UHFFFAOYSA-N |