3-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
3-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
3-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | C201-1410 |
| Compound Name: | 3-[(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methoxyphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 465.5 |
| Molecular Formula: | C23 H20 F N5 O3 S |
| Smiles: | COc1ccc(cc1)NC(c1ccc2nnc(n2c1)SCC(NCc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0527 |
| logD: | 3.0527 |
| logSw: | -3.4766 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.159 |
| InChI Key: | HPLRKOPSXSGPTR-UHFFFAOYSA-N |