N-(3,4-dimethoxyphenyl)-2-(3-oxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-2-(3-oxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl)acetamide
N-(3,4-dimethoxyphenyl)-2-(3-oxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | S336-0559 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-2-(3-oxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl)acetamide |
| Molecular Weight: | 332.36 |
| Molecular Formula: | C16 H20 N4 O4 |
| Smiles: | COc1ccc(cc1OC)NC(CN1C(N2CCCCC2=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2826 |
| logD: | 1.2826 |
| logSw: | -2.2115 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.595 |
| InChI Key: | YTWQWKCGMWEFDM-UHFFFAOYSA-N |