4-[3-(methoxymethyl)-4-(1-methyl-1H-pyrrole-2-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[3-(methoxymethyl)-4-(1-methyl-1H-pyrrole-2-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[3-(methoxymethyl)-4-(1-methyl-1H-pyrrole-2-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-0209 |
| Compound Name: | 4-[3-(methoxymethyl)-4-(1-methyl-1H-pyrrole-2-carbonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 406.41 |
| Molecular Formula: | C20 H21 F3 N4 O2 |
| Smiles: | Cn1cccc1C(N1CCN(CC1COC)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1361 |
| logD: | 3.1361 |
| logSw: | -3.2841 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 47.624 |
| InChI Key: | GLYJNZNHNGTXIO-MRXNPFEDSA-N |