N-[(4-methylphenyl)methyl]-3-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-3-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-[(4-methylphenyl)methyl]-3-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0620 |
| Compound Name: | N-[(4-methylphenyl)methyl]-3-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 473.6 |
| Molecular Formula: | C26 H27 N5 O2 S |
| Smiles: | Cc1ccc(CNC(c2ccc3nnc(n3c2)SCC(Nc2c(C)cc(C)cc2C)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9624 |
| logD: | 3.9624 |
| logSw: | -3.8306 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.219 |
| InChI Key: | VKHIDGZRWJAAFH-UHFFFAOYSA-N |