methyl 5-(adamantan-1-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Chemical Structure Depiction of
methyl 5-(adamantan-1-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
methyl 5-(adamantan-1-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | Y508-3551 |
| Compound Name: | methyl 5-(adamantan-1-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate |
| Molecular Weight: | 379.38 |
| Molecular Formula: | C19 H20 F3 N3 O2 |
| Smiles: | COC(c1cnn2c(cc(C34CC5CC(CC(C5)C4)C3)nc12)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2488 |
| logD: | 5.2488 |
| logSw: | -5.1397 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.375 |
| InChI Key: | GKAVXGFNJMSPDW-UHFFFAOYSA-N |