3-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
3-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
3-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
Compound ID: | L860-0599 |
Compound Name: | 3-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
Molecular Weight: | 473.55 |
Molecular Formula: | C25 H23 N5 O3 S |
Smiles: | CC(c1ccc(cc1)NC(CSc1nnc2ccc(cn12)C(NCc1ccc(C)cc1)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.9913 |
logD: | 2.9911 |
logSw: | -3.2799 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 83.441 |
InChI Key: | XRDDCMATBXQLQD-UHFFFAOYSA-N |