methyl 4-{2-[6-(benzylcarbamoyl)-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[6-(benzylcarbamoyl)-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetamido}benzoate
methyl 4-{2-[6-(benzylcarbamoyl)-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | L861-0446 |
| Compound Name: | methyl 4-{2-[6-(benzylcarbamoyl)-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetamido}benzoate |
| Molecular Weight: | 459.46 |
| Molecular Formula: | C24 H21 N5 O5 |
| Smiles: | COC(c1ccc(cc1)NC(CN1C(N2C=C(C=CC2=N1)C(NCc1ccccc1)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.399 |
| logD: | 2.3981 |
| logSw: | -2.8043 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.536 |
| InChI Key: | AUZZDYQNLBOYBC-UHFFFAOYSA-N |