5-cyclopropyl-4-{1-[(3-methoxyphenyl)acetyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-cyclopropyl-4-{1-[(3-methoxyphenyl)acetyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-cyclopropyl-4-{1-[(3-methoxyphenyl)acetyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0371 |
| Compound Name: | 5-cyclopropyl-4-{1-[(3-methoxyphenyl)acetyl]piperidin-4-yl}-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 370.45 |
| Molecular Formula: | C20 H26 N4 O3 |
| Smiles: | CN1C(N(C2CCN(CC2)C(Cc2cccc(c2)OC)=O)C(C2CC2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8079 |
| logD: | 2.8036 |
| logSw: | -3.1137 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.314 |
| InChI Key: | MWKSCPMSQKGKRS-UHFFFAOYSA-N |