5-cyclopropyl-2-methyl-4-[1-(thiophene-3-carbonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-cyclopropyl-2-methyl-4-[1-(thiophene-3-carbonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
5-cyclopropyl-2-methyl-4-[1-(thiophene-3-carbonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0404 |
| Compound Name: | 5-cyclopropyl-2-methyl-4-[1-(thiophene-3-carbonyl)piperidin-4-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 332.42 |
| Molecular Formula: | C16 H20 N4 O2 S |
| Smiles: | CN1C(N(C2CCN(CC2)C(c2ccsc2)=O)C(C2CC2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2421 |
| logD: | 2.2379 |
| logSw: | -2.2846 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.316 |
| InChI Key: | OHZHRKHRRSGOTH-UHFFFAOYSA-N |