3-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
3-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
3-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
Compound ID: | L860-0613 |
Compound Name: | 3-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
Molecular Weight: | 459.57 |
Molecular Formula: | C25 H25 N5 O2 S |
Smiles: | CCc1ccc(cc1)NC(CSc1nnc2ccc(cn12)C(NCc1ccc(C)cc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.3799 |
logD: | 4.3799 |
logSw: | -4.0021 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 69.615 |
InChI Key: | VFNSWJHTNMUYGJ-UHFFFAOYSA-N |