2-(3-oxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-(3-oxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
2-(3-oxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | S336-0597 |
| Compound Name: | 2-(3-oxo-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl)-N-(3,4,5-trimethoxyphenyl)acetamide |
| Molecular Weight: | 362.38 |
| Molecular Formula: | C17 H22 N4 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(CN1C(N2CCCCC2=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1283 |
| logD: | 1.1281 |
| logSw: | -2.1522 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.312 |
| InChI Key: | HQUUCGUXZHPSKV-UHFFFAOYSA-N |