3-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
3-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
3-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0272 |
| Compound Name: | 3-{[2-(2,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 481.5 |
| Molecular Formula: | C23 H20 F N5 O4 S |
| Smiles: | COc1ccc(c(c1)NC(CSc1nnc2ccc(cn12)C(Nc1cccc(c1)F)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1967 |
| logD: | 3.196 |
| logSw: | -3.4607 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.769 |
| InChI Key: | VYMCVSLTRUGUTH-UHFFFAOYSA-N |