N-methyl-N-[2-oxo-2-(4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)ethyl]thiophene-2-sulfonamide
Chemical Structure Depiction of
N-methyl-N-[2-oxo-2-(4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)ethyl]thiophene-2-sulfonamide
N-methyl-N-[2-oxo-2-(4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)ethyl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | S517-1311 |
| Compound Name: | N-methyl-N-[2-oxo-2-(4-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)ethyl]thiophene-2-sulfonamide |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C18 H27 N5 O3 S2 |
| Smiles: | CC(C)n1cnnc1CC1CCN(CC1)C(CN(C)S(c1cccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3785 |
| logD: | 1.3657 |
| logSw: | -2.3219 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 76.337 |
| InChI Key: | MAJUETHCZAFGBC-UHFFFAOYSA-N |