N-(3-fluorophenyl)-3-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-3-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-(3-fluorophenyl)-3-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0279 |
| Compound Name: | N-(3-fluorophenyl)-3-{[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C22 H18 F N5 O3 S |
| Smiles: | COc1cccc(c1)NC(CSc1nnc2ccc(cn12)C(Nc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5798 |
| logD: | 3.579 |
| logSw: | -3.7727 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.836 |
| InChI Key: | ZNTOJUKKFWVQMD-UHFFFAOYSA-N |