3-{[2-(3-bromoanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
3-{[2-(3-bromoanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
3-{[2-(3-bromoanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0328 |
| Compound Name: | 3-{[2-(3-bromoanilino)-2-oxoethyl]sulfanyl}-N-(3-fluorophenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 500.35 |
| Molecular Formula: | C21 H15 Br F N5 O2 S |
| Smiles: | C(C(Nc1cccc(c1)[Br])=O)Sc1nnc2ccc(cn12)C(Nc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3214 |
| logD: | 4.3206 |
| logSw: | -4.2894 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.293 |
| InChI Key: | WXOLJYJIIPPPAE-UHFFFAOYSA-N |