N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | Y508-7101 |
| Compound Name: | N-{1-[(4-bromophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 629.44 |
| Molecular Formula: | C28 H24 Br F3 N6 O3 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(cc2)[Br])n1)NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8333 |
| logD: | 4.833 |
| logSw: | -4.6846 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.636 |
| InChI Key: | QJNUSFWDQCSJKQ-UHFFFAOYSA-N |