N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P573-6721 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 436.4 |
| Molecular Formula: | C21 H17 F N6 O4 |
| Smiles: | C(C(Nc1ccc2c(c1)OCCO2)=O)N1C(N2C=CC(Nc3ccc(cc3)F)=NC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7977 |
| logD: | 1.7952 |
| logSw: | -2.4394 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.818 |
| InChI Key: | FASLDEDJGQUSCB-UHFFFAOYSA-N |