N-(2H-1,3-benzodioxol-4-yl)-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-4-yl)-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
N-(2H-1,3-benzodioxol-4-yl)-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | Y500-0646 |
| Compound Name: | N-(2H-1,3-benzodioxol-4-yl)-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 505.25 |
| Molecular Formula: | C21 H12 Br F3 N4 O3 |
| Smiles: | C1Oc2cccc(c2O1)NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6554 |
| logD: | 5.6535 |
| logSw: | -5.9451 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.591 |
| InChI Key: | JQFQSYLRMZJVIF-UHFFFAOYSA-N |