7-(difluoromethyl)-N-{3-[5-methyl-2-(propan-2-yl)phenoxy]-5-nitrophenyl}-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
7-(difluoromethyl)-N-{3-[5-methyl-2-(propan-2-yl)phenoxy]-5-nitrophenyl}-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
7-(difluoromethyl)-N-{3-[5-methyl-2-(propan-2-yl)phenoxy]-5-nitrophenyl}-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y500-8311 |
| Compound Name: | 7-(difluoromethyl)-N-{3-[5-methyl-2-(propan-2-yl)phenoxy]-5-nitrophenyl}-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 557.56 |
| Molecular Formula: | C30 H25 F2 N5 O4 |
| Smiles: | CC(C)c1ccc(C)cc1Oc1cc(cc(c1)[N+]([O-])=O)NC(c1cnn2c(cc(c3ccccc3)nc12)C(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4676 |
| logD: | 7.4561 |
| logSw: | -5.5798 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.475 |
| InChI Key: | JFLXVLJXQHOCOB-UHFFFAOYSA-N |