1-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]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-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-one
1-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | Y020-7383 |
| Compound Name: | 1-(4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 421.58 |
| Molecular Formula: | C16 H15 N5 O S4 |
| Smiles: | CC1(C)C2=C(C(=S)SS2)c2ccccc2N1C(CSc1nnnn1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6205 |
| logD: | 2.6205 |
| logSw: | -3.2482 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 54.25 |
| InChI Key: | ZGZIRVKPMJCNKV-UHFFFAOYSA-N |