2-(2-benzoyl-4-chloroanilino)-2-oxoethyl piperidine-1-carbodithioate
Chemical Structure Depiction of
2-(2-benzoyl-4-chloroanilino)-2-oxoethyl piperidine-1-carbodithioate
2-(2-benzoyl-4-chloroanilino)-2-oxoethyl piperidine-1-carbodithioate
Compound characteristics
| Compound ID: | Y020-5890 |
| Compound Name: | 2-(2-benzoyl-4-chloroanilino)-2-oxoethyl piperidine-1-carbodithioate |
| Molecular Weight: | 432.99 |
| Molecular Formula: | C21 H21 Cl N2 O2 S2 |
| Smiles: | C1CCN(CC1)C(=S)SCC(Nc1ccc(cc1C(c1ccccc1)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9225 |
| logD: | 4.9184 |
| logSw: | -4.9765 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.977 |
| InChI Key: | LHGKZLRQHJQOAC-UHFFFAOYSA-N |