4-[3-(methoxymethyl)-4-(1-methyl-1H-pyrazole-4-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[3-(methoxymethyl)-4-(1-methyl-1H-pyrazole-4-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[3-(methoxymethyl)-4-(1-methyl-1H-pyrazole-4-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0246 |
| Compound Name: | 4-[3-(methoxymethyl)-4-(1-methyl-1H-pyrazole-4-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 407.39 |
| Molecular Formula: | C19 H20 F3 N5 O2 |
| Smiles: | Cn1cc(cn1)C(N1CCN(CC1COC)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5813 |
| logD: | 1.5813 |
| logSw: | -2.1654 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 60.016 |
| InChI Key: | MDLWJLWLKUQVGS-MRXNPFEDSA-N |