3-{[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
3-{[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
3-{[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
Compound ID: | L860-0284 |
Compound Name: | 3-{[2-(2,6-dimethylanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
Molecular Weight: | 449.51 |
Molecular Formula: | C23 H20 F N5 O2 S |
Smiles: | Cc1cccc(C)c1NC(CSc1nnc2ccc(cn12)C(Nc1cccc(c1)F)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.698 |
logD: | 3.6973 |
logSw: | -3.7912 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 66.897 |
InChI Key: | QLNRVABCPJBXLC-UHFFFAOYSA-N |