N-[(4-methylphenyl)methyl]-2-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-[(4-methylphenyl)methyl]-2-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L861-0617 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C24 H23 N5 O3 S |
| Smiles: | Cc1ccc(CNC(C2C=CC3=NN(CC(Nc4cccc(c4)SC)=O)C(N3C=2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1925 |
| logD: | 3.1917 |
| logSw: | -3.3378 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.362 |
| InChI Key: | BPYXOSZQQNCCPF-UHFFFAOYSA-N |