5-(piperidin-3-yl)-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-(piperidin-3-yl)-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one--hydrogen chloride (1/1)
5-(piperidin-3-yl)-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | P940-1320 |
| Compound Name: | 5-(piperidin-3-yl)-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one--hydrogen chloride (1/1) |
| Molecular Weight: | 246.74 |
| Molecular Formula: | C10 H18 N4 O |
| Salt: | HCl |
| Smiles: | [H]N1CCCC(C1)C1=NNC(N1C(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5527 |
| logD: | -2.5511 |
| logSw: | -0.9038 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.823 |
| InChI Key: | FGPBRMNSAHKJFQ-QMMMGPOBSA-N |