1-(3-chloro-4-fluorophenyl)-3-methyl-4-(4-methylbenzene-1-sulfonyl)piperazin-2-one
Chemical Structure Depiction of
1-(3-chloro-4-fluorophenyl)-3-methyl-4-(4-methylbenzene-1-sulfonyl)piperazin-2-one
1-(3-chloro-4-fluorophenyl)-3-methyl-4-(4-methylbenzene-1-sulfonyl)piperazin-2-one
Compound characteristics
| Compound ID: | V019-1933 |
| Compound Name: | 1-(3-chloro-4-fluorophenyl)-3-methyl-4-(4-methylbenzene-1-sulfonyl)piperazin-2-one |
| Molecular Weight: | 396.87 |
| Molecular Formula: | C18 H18 Cl F N2 O3 S |
| Smiles: | CC1C(N(CCN1S(c1ccc(C)cc1)(=O)=O)c1ccc(c(c1)[Cl])F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6346 |
| logD: | 3.6346 |
| logSw: | -3.9089 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.815 |
| InChI Key: | CBTVFWWIXJXPSZ-ZDUSSCGKSA-N |