(4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)[1-(pyrrolidine-1-sulfonyl)piperidin-3-yl]methanone
Chemical Structure Depiction of
(4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)[1-(pyrrolidine-1-sulfonyl)piperidin-3-yl]methanone
(4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)[1-(pyrrolidine-1-sulfonyl)piperidin-3-yl]methanone
Compound characteristics
| Compound ID: | S517-1361 |
| Compound Name: | (4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)[1-(pyrrolidine-1-sulfonyl)piperidin-3-yl]methanone |
| Molecular Weight: | 452.62 |
| Molecular Formula: | C21 H36 N6 O3 S |
| Smiles: | CC(C)n1cnnc1CC1CCN(CC1)C(C1CCCN(C1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1106 |
| logD: | 1.0977 |
| logSw: | -1.6555 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.427 |
| InChI Key: | VBPCRCMGDSYMDR-IBGZPJMESA-N |