2-{2-[(2H-1,3-benzodioxol-5-yl)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-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-N-(4-methoxyphenyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
2-{2-[(2H-1,3-benzodioxol-5-yl)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: | L861-0018 |
| Compound Name: | 2-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-N-(4-methoxyphenyl)-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 461.43 |
| Molecular Formula: | C23 H19 N5 O6 |
| Smiles: | COc1ccc(cc1)NC(C1C=CC2=NN(CC(Nc3ccc4c(c3)OCO4)=O)C(N2C=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4617 |
| logD: | 2.4563 |
| logSw: | -3.0305 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.699 |
| InChI Key: | VEZHQBJUZXKBOW-UHFFFAOYSA-N |