5-(adamantan-1-yl)-3-bromo-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
5-(adamantan-1-yl)-3-bromo-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
5-(adamantan-1-yl)-3-bromo-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | Y502-0967 |
| Compound Name: | 5-(adamantan-1-yl)-3-bromo-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine |
| Molecular Weight: | 414.27 |
| Molecular Formula: | C18 H19 Br F3 N3 |
| Smiles: | Cc1c(c2nc(cc(C(F)(F)F)n2n1)C12CC3CC(CC(C3)C2)C1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.921 |
| logD: | 5.9209 |
| logSw: | -5.6677 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 19.5541 |
| InChI Key: | RCXNKEHRGQULHS-UHFFFAOYSA-N |