4-methyl-5-(4-methylphenyl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
4-methyl-5-(4-methylphenyl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione
4-methyl-5-(4-methylphenyl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-0035 |
| Compound Name: | 4-methyl-5-(4-methylphenyl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 449.49 |
| Molecular Formula: | C22 H22 F3 N3 O2 S |
| Smiles: | CC1=C(c2ccc(C)cc2)S(N=C1N1CCN(CC1)c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8004 |
| logD: | 4.8004 |
| logSw: | -4.6594 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.391 |
| InChI Key: | AJELGTCYTHZOMD-UHFFFAOYSA-N |