5-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
5-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-1255 |
| Compound Name: | 5-[1-(1H-indole-2-carbonyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 367.45 |
| Molecular Formula: | C20 H25 N5 O2 |
| Smiles: | CC(C)N1C(C2CCN(CC2)C(c2cc3ccccc3[nH]2)=O)=NN(C)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.3631 |
| logD: | 3.3569 |
| logSw: | -3.5638 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.086 |
| InChI Key: | GTSMNTCUAIJKEP-UHFFFAOYSA-N |