1-{[4-(2,5-dichlorophenyl)piperazine-1-sulfonyl]methyl}-7,7-dimethylbicyclo[2.2.1]heptan-2-one
Chemical Structure Depiction of
1-{[4-(2,5-dichlorophenyl)piperazine-1-sulfonyl]methyl}-7,7-dimethylbicyclo[2.2.1]heptan-2-one
1-{[4-(2,5-dichlorophenyl)piperazine-1-sulfonyl]methyl}-7,7-dimethylbicyclo[2.2.1]heptan-2-one
Compound characteristics
| Compound ID: | 8017-3450 |
| Compound Name: | 1-{[4-(2,5-dichlorophenyl)piperazine-1-sulfonyl]methyl}-7,7-dimethylbicyclo[2.2.1]heptan-2-one |
| Molecular Weight: | 445.41 |
| Molecular Formula: | C20 H26 Cl2 N2 O3 S |
| Smiles: | CC1(C)C2CCC1(CS(N1CCN(CC1)c1cc(ccc1[Cl])[Cl])(=O)=O)C(C2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4729 |
| logD: | 4.4729 |
| logSw: | -4.538 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.896 |
| InChI Key: | SXEPUCNUHGLCHC-UHFFFAOYSA-N |