5-cyclopropyl-2-methyl-4-{1-[(pyridin-4-yl)acetyl]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)acetyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one
5-cyclopropyl-2-methyl-4-{1-[(pyridin-4-yl)acetyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0427 |
| Compound Name: | 5-cyclopropyl-2-methyl-4-{1-[(pyridin-4-yl)acetyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 341.41 |
| Molecular Formula: | C18 H23 N5 O2 |
| Smiles: | CN1C(N(C2CCN(CC2)C(Cc2ccncc2)=O)C(C2CC2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3504 |
| logD: | 1.3378 |
| logSw: | -1.0081 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.198 |
| InChI Key: | ZIVJPKOHYVBPAG-UHFFFAOYSA-N |