7-(5-bromo-2-fluorophenyl)-N~6~-(4-methoxyphenyl)-5-methyl-N~3~-(3-methylphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide
Chemical Structure Depiction of
7-(5-bromo-2-fluorophenyl)-N~6~-(4-methoxyphenyl)-5-methyl-N~3~-(3-methylphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide
7-(5-bromo-2-fluorophenyl)-N~6~-(4-methoxyphenyl)-5-methyl-N~3~-(3-methylphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide
Compound characteristics
Compound ID: | E918-0272 |
Compound Name: | 7-(5-bromo-2-fluorophenyl)-N~6~-(4-methoxyphenyl)-5-methyl-N~3~-(3-methylphenyl)-4,7-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide |
Molecular Weight: | 590.45 |
Molecular Formula: | C29 H25 Br F N5 O3 |
Smiles: | CC1=C(C(c2cc(ccc2F)[Br])n2c(c(cn2)C(Nc2cccc(C)c2)=O)N1)C(Nc1ccc(cc1)OC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.0737 |
logD: | 6.0729 |
logSw: | -5.4073 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 77.89 |
InChI Key: | QVIKMIBOCGHELW-SANMLTNESA-N |