(4-benzylpiperazin-1-yl)[rel-(5R,7S)-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone
Chemical Structure Depiction of
(4-benzylpiperazin-1-yl)[rel-(5R,7S)-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone
(4-benzylpiperazin-1-yl)[rel-(5R,7S)-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone
Compound characteristics
| Compound ID: | 3209-0737 |
| Compound Name: | (4-benzylpiperazin-1-yl)[rel-(5R,7S)-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone |
| Molecular Weight: | 529.56 |
| Molecular Formula: | C27 H30 F3 N5 O3 |
| Smiles: | COc1ccc(cc1OC)[C@H]1C[C@@H](C(F)(F)F)n2c(c(cn2)C(N2CCN(CC2)Cc2ccccc2)=O)N1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.4809 |
| logD: | 3.4655 |
| logSw: | -3.5884 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.964 |
| InChI Key: | UWDUOLDKFKGQJB-ZJSXRUAMSA-N |