5-benzyl-8-methoxy-4,4-dimethyl-N-(4-methylphenyl)-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-imine
Chemical Structure Depiction of
5-benzyl-8-methoxy-4,4-dimethyl-N-(4-methylphenyl)-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-imine
5-benzyl-8-methoxy-4,4-dimethyl-N-(4-methylphenyl)-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-imine
Compound characteristics
Compound ID: | Y020-5414 |
Compound Name: | 5-benzyl-8-methoxy-4,4-dimethyl-N-(4-methylphenyl)-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-imine |
Molecular Weight: | 458.64 |
Molecular Formula: | C27 H26 N2 O S2 |
Smiles: | Cc1ccc(cc1)/N=C1/C2=C(C(C)(C)N(Cc3ccccc3)c3ccc(cc23)OC)SS1 |
Stereo: | ACHIRAL |
logP: | 6.7395 |
logD: | 6.7395 |
logSw: | -5.8591 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 17.136 |
InChI Key: | JWSCMUJLKGJPGR-UHFFFAOYSA-N |