2-(4-chlorophenoxy)-1-(4,4,7,8-tetramethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenoxy)-1-(4,4,7,8-tetramethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethan-1-one
2-(4-chlorophenoxy)-1-(4,4,7,8-tetramethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethan-1-one
Compound characteristics
| Compound ID: | 3807-5876 |
| Compound Name: | 2-(4-chlorophenoxy)-1-(4,4,7,8-tetramethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethan-1-one |
| Molecular Weight: | 462.05 |
| Molecular Formula: | C22 H20 Cl N O2 S3 |
| Smiles: | Cc1cc2C3=C(C(C)(C)N(C(COc4ccc(cc4)[Cl])=O)c2cc1C)SSC3=S |
| Stereo: | ACHIRAL |
| logP: | 5.8844 |
| logD: | 5.8844 |
| logSw: | -5.9753 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 21.4061 |
| InChI Key: | NWRLRGISPRWKQF-UHFFFAOYSA-N |