N-(4-ethylphenyl)-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
N-(4-ethylphenyl)-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P573-6292 |
| Compound Name: | N-(4-ethylphenyl)-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C22 H22 N6 O2 |
| Smiles: | CCc1ccc(cc1)NC(CN1C(N2C=CC(Nc3ccc(C)cc3)=NC2=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1502 |
| logD: | 4.1496 |
| logSw: | -4.0129 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.995 |
| InChI Key: | ZXMRCLKECOJIFQ-UHFFFAOYSA-N |