N-(2H-1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | J093-0002 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 445.33 |
| Molecular Formula: | C20 H11 F4 N5 O3 |
| Smiles: | C1Oc2ccc(cc2O1)NC(c1nc2nc(cc(C(F)(F)F)n2n1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2752 |
| logD: | 4.2749 |
| logSw: | -4.4922 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.988 |
| InChI Key: | QNZFVEKHFMXZGN-UHFFFAOYSA-N |