3-{[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
3-{[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
3-{[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0242 |
| Compound Name: | 3-{[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 485.92 |
| Molecular Formula: | C22 H17 Cl F N5 O3 S |
| Smiles: | COc1ccc(cc1[Cl])NC(CSc1nnc2ccc(cn12)C(Nc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0239 |
| logD: | 4.0232 |
| logSw: | -4.4059 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.923 |
| InChI Key: | XCGWTRFNIAGNGV-UHFFFAOYSA-N |