N-benzyl-3-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-3-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-benzyl-3-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0424 |
| Compound Name: | N-benzyl-3-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C24 H23 N5 O2 S |
| Smiles: | Cc1ccc(CNC(CSc2nnc3ccc(cn23)C(NCc2ccccc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1305 |
| logD: | 3.1305 |
| logSw: | -3.1909 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.937 |
| InChI Key: | JPPDJTCCJSQDAO-UHFFFAOYSA-N |