2-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-N-(4-methoxyphenyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
2-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-N-(4-methoxyphenyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
2-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-N-(4-methoxyphenyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L861-0068 |
| Compound Name: | 2-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-N-(4-methoxyphenyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 465.89 |
| Molecular Formula: | C23 H20 Cl N5 O4 |
| Smiles: | COc1ccc(cc1)NC(C1C=CC2=NN(CC(NCc3ccc(cc3)[Cl])=O)C(N2C=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8011 |
| logD: | 2.7956 |
| logSw: | -3.6044 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.906 |
| InChI Key: | MPFSWHUGGAPMKY-UHFFFAOYSA-N |