O-butyl S-[2-(4-methylanilino)-2-oxoethyl] carbonodithioate
Chemical Structure Depiction of
O-butyl S-[2-(4-methylanilino)-2-oxoethyl] carbonodithioate
O-butyl S-[2-(4-methylanilino)-2-oxoethyl] carbonodithioate
Compound characteristics
| Compound ID: | 0217-0131 |
| Compound Name: | O-butyl S-[2-(4-methylanilino)-2-oxoethyl] carbonodithioate |
| Molecular Weight: | 297.44 |
| Molecular Formula: | C14 H19 N O2 S2 |
| Smiles: | CCCCOC(=S)SCC(Nc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2208 |
| logD: | 4.2208 |
| logSw: | -4.0741 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.0847 |
| InChI Key: | RTEQFQDRZNEMQC-UHFFFAOYSA-N |