2-(2-benzoyl-4-chloroanilino)-2-oxoethyl cyclohexyl(methyl)carbamodithioate
Chemical Structure Depiction of
2-(2-benzoyl-4-chloroanilino)-2-oxoethyl cyclohexyl(methyl)carbamodithioate
2-(2-benzoyl-4-chloroanilino)-2-oxoethyl cyclohexyl(methyl)carbamodithioate
Compound characteristics
| Compound ID: | Y020-5896 |
| Compound Name: | 2-(2-benzoyl-4-chloroanilino)-2-oxoethyl cyclohexyl(methyl)carbamodithioate |
| Molecular Weight: | 461.04 |
| Molecular Formula: | C23 H25 Cl N2 O2 S2 |
| Smiles: | CN(C1CCCCC1)C(=S)SCC(Nc1ccc(cc1C(c1ccccc1)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5605 |
| logD: | 5.5564 |
| logSw: | -5.8013 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.531 |
| InChI Key: | MQDFTEHVJQQWMK-UHFFFAOYSA-N |