[1-(1-methyl-1H-pyrazole-4-sulfonyl)piperidin-3-yl](4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone
Chemical Structure Depiction of
[1-(1-methyl-1H-pyrazole-4-sulfonyl)piperidin-3-yl](4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone
[1-(1-methyl-1H-pyrazole-4-sulfonyl)piperidin-3-yl](4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | Y502-8101 |
| Compound Name: | [1-(1-methyl-1H-pyrazole-4-sulfonyl)piperidin-3-yl](4-{[3-(trifluoromethyl)phenyl]methyl}piperazin-1-yl)methanone |
| Molecular Weight: | 499.55 |
| Molecular Formula: | C22 H28 F3 N5 O3 S |
| Smiles: | Cn1cc(cn1)S(N1CCCC(C1)C(N1CCN(CC1)Cc1cccc(c1)C(F)(F)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3141 |
| logD: | 1.3077 |
| logSw: | -2.3176 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.881 |
| InChI Key: | MWZWLLOLOSDRIJ-SFHVURJKSA-N |