N-benzyl-3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-benzyl-3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0397 |
| Compound Name: | N-benzyl-3-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C24 H23 N5 O4 S |
| Smiles: | COc1ccc(c(c1)OC)NC(CSc1nnc2ccc(cn12)C(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.771 |
| logD: | 2.7709 |
| logSw: | -3.4119 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.091 |
| InChI Key: | DXCAZCCZPXGBSE-UHFFFAOYSA-N |