N-ethyl-2-[5-(4-fluoroanilino)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-phenylacetamide
Chemical Structure Depiction of
N-ethyl-2-[5-(4-fluoroanilino)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-phenylacetamide
N-ethyl-2-[5-(4-fluoroanilino)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-phenylacetamide
Compound characteristics
| Compound ID: | P572-5069 |
| Compound Name: | N-ethyl-2-[5-(4-fluoroanilino)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]-N-phenylacetamide |
| Molecular Weight: | 420.45 |
| Molecular Formula: | C22 H21 F N6 O2 |
| Smiles: | CCN(C(CN1C(N2C(C=C(C)N=C2Nc2ccc(cc2)F)=N1)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1218 |
| logD: | 3.1149 |
| logSw: | -3.2537 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.737 |
| InChI Key: | HRZRPGHQUHNWRI-UHFFFAOYSA-N |