2-methyl-4-(propan-2-yl)-5-{1-[(thiophen-2-yl)acetyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
2-methyl-4-(propan-2-yl)-5-{1-[(thiophen-2-yl)acetyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one
2-methyl-4-(propan-2-yl)-5-{1-[(thiophen-2-yl)acetyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-1256 |
| Compound Name: | 2-methyl-4-(propan-2-yl)-5-{1-[(thiophen-2-yl)acetyl]piperidin-4-yl}-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 348.47 |
| Molecular Formula: | C17 H24 N4 O2 S |
| Smiles: | CC(C)N1C(C2CCN(CC2)C(Cc2cccs2)=O)=NN(C)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.2006 |
| logD: | 2.1944 |
| logSw: | -2.2772 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.228 |
| InChI Key: | NZUKJNUWLHZKFT-UHFFFAOYSA-N |