methyl (adamantan-1-yl){[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}acetate
Chemical Structure Depiction of
methyl (adamantan-1-yl){[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}acetate
methyl (adamantan-1-yl){[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}acetate
Compound characteristics
Compound ID: | K061-0077 |
Compound Name: | methyl (adamantan-1-yl){[5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino}acetate |
Molecular Weight: | 542.56 |
Molecular Formula: | C28 H29 F3 N4 O4 |
Smiles: | COC(C(C12CC3CC(CC(C3)C2)C1)NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1ccc(cc1)OC)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.7131 |
logD: | 5.7131 |
logSw: | -5.4844 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.914 |
InChI Key: | LUGHIQLGYMZJBX-PWZBTASGSA-N |