4-[2-(methoxymethyl)-4-(pyridine-3-sulfonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Chemical Structure Depiction of
4-[2-(methoxymethyl)-4-(pyridine-3-sulfonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
4-[2-(methoxymethyl)-4-(pyridine-3-sulfonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile
Compound characteristics
| Compound ID: | S956-5182 |
| Compound Name: | 4-[2-(methoxymethyl)-4-(pyridine-3-sulfonyl)piperazin-1-yl]-2-(trifluoromethyl)benzonitrile |
| Molecular Weight: | 440.44 |
| Molecular Formula: | C19 H19 F3 N4 O3 S |
| Smiles: | COCC1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)S(c1cccnc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1607 |
| logD: | 2.1607 |
| logSw: | -2.5244 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.787 |
| InChI Key: | RFULXDGSNZJLOV-MRXNPFEDSA-N |