N-(cyanomethyl)-3-methyl-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Chemical Structure Depiction of
N-(cyanomethyl)-3-methyl-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
N-(cyanomethyl)-3-methyl-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide
Compound characteristics
| Compound ID: | P048-0250 |
| Compound Name: | N-(cyanomethyl)-3-methyl-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-sulfonamide |
| Molecular Weight: | 341.39 |
| Molecular Formula: | C16 H15 N5 O2 S |
| Smiles: | Cc1cccc(c1)N(CC#N)S(c1ccc2nnc(C)n2c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.342 |
| logD: | 1.342 |
| logSw: | -2.1991 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.814 |
| InChI Key: | ZLLRESZUQJGRDC-UHFFFAOYSA-N |