methyl 4-[2-({6-[(3-fluorophenyl)carbamoyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-({6-[(3-fluorophenyl)carbamoyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamido]benzoate
methyl 4-[2-({6-[(3-fluorophenyl)carbamoyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamido]benzoate
Compound characteristics
| Compound ID: | L860-0253 |
| Compound Name: | methyl 4-[2-({6-[(3-fluorophenyl)carbamoyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamido]benzoate |
| Molecular Weight: | 479.49 |
| Molecular Formula: | C23 H18 F N5 O4 S |
| Smiles: | COC(c1ccc(cc1)NC(CSc1nnc2ccc(cn12)C(Nc1cccc(c1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6041 |
| logD: | 3.6033 |
| logSw: | -3.7857 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.466 |
| InChI Key: | USAXDWIMJDQHAI-UHFFFAOYSA-N |