N-benzyl-2-(2-{[(4-methoxyphenyl)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-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-benzyl-2-(2-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L861-0496 |
| Compound Name: | N-benzyl-2-(2-{[(4-methoxyphenyl)methyl]amino}-2-oxoethyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 445.48 |
| Molecular Formula: | C24 H23 N5 O4 |
| Smiles: | COc1ccc(CNC(CN2C(N3C=C(C=CC3=N2)C(NCc2ccccc2)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.8683 |
| logD: | 1.8675 |
| logSw: | -2.3567 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.228 |
| InChI Key: | YUNTWGQLJNHBAE-UHFFFAOYSA-N |