1-(adamantan-1-yl)propan-2-yl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Chemical Structure Depiction of
1-(adamantan-1-yl)propan-2-yl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
1-(adamantan-1-yl)propan-2-yl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | D372-0076 |
| Compound Name: | 1-(adamantan-1-yl)propan-2-yl 5-(2-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate |
| Molecular Weight: | 513.56 |
| Molecular Formula: | C28 H30 F3 N3 O3 |
| Smiles: | CC(CC12CC3CC(CC(C3)C2)C1)OC(c1cnn2c(cc(c3ccccc3OC)nc12)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.3196 |
| logD: | 7.3196 |
| logSw: | -5.7158 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.876 |
| InChI Key: | ZOYGEBGTZQBLDF-ZCZKMIILSA-N |