1-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(4-methoxyphenoxy)ethan-1-one
Chemical Structure Depiction of
1-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(4-methoxyphenoxy)ethan-1-one
1-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(4-methoxyphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | 3390-0188 |
| Compound Name: | 1-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(4-methoxyphenoxy)ethan-1-one |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C21 H19 N O3 S3 |
| Smiles: | CC1(C)C2=C(C(=S)SS2)c2ccccc2N1C(COc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2359 |
| logD: | 4.2359 |
| logSw: | -4.4237 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 28.9499 |
| InChI Key: | MFKWEFNLQIORIP-UHFFFAOYSA-N |