2-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl 4-methylpiperidine-1-carbodithioate
Chemical Structure Depiction of
2-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl 4-methylpiperidine-1-carbodithioate
2-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl 4-methylpiperidine-1-carbodithioate
Compound characteristics
| Compound ID: | 4151-0502 |
| Compound Name: | 2-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl 4-methylpiperidine-1-carbodithioate |
| Molecular Weight: | 480.75 |
| Molecular Formula: | C21 H24 N2 O S5 |
| Smiles: | CC1CCN(CC1)C(=S)SCC(N1c2ccccc2C2=C(C1(C)C)SSC2=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1146 |
| logD: | 5.1146 |
| logSw: | -4.973 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 16.9987 |
| InChI Key: | IBUVTWUMGRVKTE-UHFFFAOYSA-N |