N-benzyl-2-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-2-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-benzyl-2-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L861-0497 |
| Compound Name: | N-benzyl-2-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 449.9 |
| Molecular Formula: | C23 H20 Cl N5 O3 |
| Smiles: | C(c1ccccc1)NC(C1C=CC2=NN(CC(NCc3ccccc3[Cl])=O)C(N2C=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.668 |
| logD: | 2.6671 |
| logSw: | -3.4033 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.684 |
| InChI Key: | MYQVLQVIHDLYND-UHFFFAOYSA-N |