1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(piperidin-1-yl)ethan-1-one
1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 4477-1005 |
| Compound Name: | 1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 434.64 |
| Molecular Formula: | C21 H26 N2 O2 S3 |
| Smiles: | CCOc1ccc2c(c1)C1=C(C(C)(C)N2C(CN2CCCCC2)=O)SSC1=S |
| Stereo: | ACHIRAL |
| logP: | 4.0025 |
| logD: | 3.9999 |
| logSw: | -4.0904 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 25.0347 |
| InChI Key: | RGALZVGXCOTFBE-UHFFFAOYSA-N |