methyl 4-[2-({6-[(3-methylphenyl)carbamoyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-({6-[(3-methylphenyl)carbamoyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamido]benzoate
methyl 4-[2-({6-[(3-methylphenyl)carbamoyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamido]benzoate
Compound characteristics
| Compound ID: | L860-0124 |
| Compound Name: | methyl 4-[2-({6-[(3-methylphenyl)carbamoyl][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)acetamido]benzoate |
| Molecular Weight: | 475.53 |
| Molecular Formula: | C24 H21 N5 O4 S |
| Smiles: | Cc1cccc(c1)NC(c1ccc2nnc(n2c1)SCC(Nc1ccc(cc1)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8106 |
| logD: | 3.8105 |
| logSw: | -3.8447 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.466 |
| InChI Key: | HOWNBIYBMQQBNZ-UHFFFAOYSA-N |