N-methyl-N-(2-oxo-2-{4-[(4-phenyl-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-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethyl)thiophene-2-sulfonamide
N-methyl-N-(2-oxo-2-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethyl)thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | S517-1123 |
| Compound Name: | N-methyl-N-(2-oxo-2-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethyl)thiophene-2-sulfonamide |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C21 H25 N5 O3 S2 |
| Smiles: | CN(CC(N1CCC(CC1)Cc1nncn1c1ccccc1)=O)S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9829 |
| logD: | 1.9826 |
| logSw: | -2.4991 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.733 |
| InChI Key: | NCYKUOFDDGEQMW-UHFFFAOYSA-N |