AC1LUH35

1-(8-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)hexan-1-one

Also Known As: BAS 00126937|AG-690/36895048|SR-01000449781-1|1-(8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)hexan-1-one|1-(8-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)hexan-1-one|1-(8-ethoxy-4,4-dimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)hexan-1-one|8-ethoxy-5-hexanoyl-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione|1-(8-Ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-2,3-dithia-5-aza-cyclopenta[a]naphthalen-5-yl)-hexan-1-one|1-(8-ethoxy-4,4-dimethyl-1-thioxo-4,5-dihydro-1,2-dithioleno[5,4-c]quinolin-5- yl)hexan-1-one|1-{8-ETHOXY-4,4-DIMETHYL-1-SULFANYLIDENE-1H,4H,5H-[1,2]DITHIOLO[3,4-C]QUINOLIN-5-YL}HEXAN-1-ONE

Molecular Formula	C20H25NO2S3
Molecular Weight	407.10474 g/mol
LogP	6.76679
Topological Polar Surface Area	29.54 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	407.10474
Monoisotopic Mass	407.10474
Heavy Atoms	26
Complexity	866.1815

Chemical Identifiers

CAS Number	301655-80-1
SMILES	CCCCCC(=O)N1C2=C(C=C(C=C2)OCC)C3=C(C1(C)C)SSC3=S