N-(4-methoxyphenyl)-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-methoxyphenyl)-2-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-(4-methoxyphenyl)-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: | L861-0041 |
| Compound Name: | N-(4-methoxyphenyl)-2-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C23 H21 N5 O4 S |
| Smiles: | COc1ccc(cc1)NC(C1C=CC2=NN(CC(Nc3cccc(c3)SC)=O)C(N2C=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0896 |
| logD: | 3.0841 |
| logSw: | -3.5545 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.584 |
| InChI Key: | HGARXHGZOQTTSB-UHFFFAOYSA-N |