3-{[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
3-{[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
3-{[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0263 |
| Compound Name: | 3-{[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 499.95 |
| Molecular Formula: | C23 H19 Cl F N5 O3 S |
| Smiles: | Cc1cc(c(cc1[Cl])OC)NC(CSc1nnc2ccc(cn12)C(Nc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4643 |
| logD: | 4.4624 |
| logSw: | -4.5415 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.225 |
| InChI Key: | NGYWOCVROXNMSW-UHFFFAOYSA-N |