N-benzyl-2-[2-(5-chloro-2,4-dimethoxyanilino)-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-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-benzyl-2-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L861-0493 |
| Compound Name: | N-benzyl-2-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 495.92 |
| Molecular Formula: | C24 H22 Cl N5 O5 |
| Smiles: | COc1cc(c(cc1NC(CN1C(N2C=C(C=CC2=N1)C(NCc1ccccc1)=O)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 2.607 |
| logD: | 2.6048 |
| logSw: | -3.361 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.925 |
| InChI Key: | FNOVZPSJDPPWRR-UHFFFAOYSA-N |