N-(3-methylbutyl)-2-[5-methyl-3-oxo-7-(pyridin-2-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-methylbutyl)-2-[5-methyl-3-oxo-7-(pyridin-2-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(3-methylbutyl)-2-[5-methyl-3-oxo-7-(pyridin-2-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P032-2736 |
| Compound Name: | N-(3-methylbutyl)-2-[5-methyl-3-oxo-7-(pyridin-2-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 354.41 |
| Molecular Formula: | C18 H22 N6 O2 |
| Smiles: | CC(C)CCNC(CN1C(N2C(C)=NC(=CC2=N1)c1ccccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4533 |
| logD: | 1.4449 |
| logSw: | -2.0867 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.622 |
| InChI Key: | XEAHKRHWZIGSLA-UHFFFAOYSA-N |