4-methyl-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-methyl-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzene-1-sulfonamide
4-methyl-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | J011-0258 |
| Compound Name: | 4-methyl-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzene-1-sulfonamide |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C18 H17 N5 O2 S2 |
| Smiles: | Cc1ccc(cc1)S(NCc1ccc(cc1)c1nn2c(C)nnc2s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.801 |
| logD: | 2.8008 |
| logSw: | -3.3748 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.528 |
| InChI Key: | ITCLRHTZFNSEQY-UHFFFAOYSA-N |