{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(4-methylpiperidine-1-sulfonyl)piperidin-4-yl]methanone
Chemical Structure Depiction of
{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(4-methylpiperidine-1-sulfonyl)piperidin-4-yl]methanone
{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(4-methylpiperidine-1-sulfonyl)piperidin-4-yl]methanone
Compound characteristics
| Compound ID: | S517-1454 |
| Compound Name: | {4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}[1-(4-methylpiperidine-1-sulfonyl)piperidin-4-yl]methanone |
| Molecular Weight: | 466.65 |
| Molecular Formula: | C22 H38 N6 O3 S |
| Smiles: | CCn1cnnc1CC1CCN(CC1)C(C1CCN(CC1)S(N1CCC(C)CC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4215 |
| logD: | 1.4175 |
| logSw: | -1.7361 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.061 |
| InChI Key: | VAIMPMFYPKNCIJ-UHFFFAOYSA-N |