AC1MJHBT

tetramethyl 9'-ethoxy-5',5'-dimethylspiro[1,3-dithiole-2,1'-6H-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate

Also Known As: ChemDiv1_022801|DivK1c_004065|HMS651M09|tetramethyl 9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate|CDS1_003025|BAS 00126816|AG-690/33251007|SR-01000449749-1|tetramethyl 9'-ethoxy-5',5'-dimethylspiro[1,3-dithiole-2,1'-6H-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate|2',3',4,5-tetramethyl 9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate|spiro[1,3-dithiole-2,1'-[1H]thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylic acid, 9'-ethoxy-5',6'-dihydro-5',5'-dimethyl-, tetramethyl ester|tetramethyl 9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro(1,3-dithiole-2,1'-1H-thiopyrano[2,3-c]quinoline)-2',3',4,5-tetracarboxylate|tetramethyl 9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate|Tetramethyl 9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro1,3-dithiole-2,1'-thiopyrano2,3-cquinoline-2',3',4,5-tetracarboxylate|tetramethyl 9'-ethoxy-5',5'-dimethyl-spiro[1,3-dithiole-2,1'-6H-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate|Tetramethyl 9-ethoxy-5,5-dimethyl-5,6-dihydrospiro[thiopyrano[2,3-c]quinoline-1,2'-[1,3]dithiole]-2,3,4',5'-tetracarboxylate|tetramethyl9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate

Molecular Formula	C26H27NO9S3
Molecular Weight	593.0848 g/mol
LogP	4.0813
Topological Polar Surface Area	126.46 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	13
Rotatable Bonds	6
Exact Mass	593.0848
Monoisotopic Mass	593.0848
Heavy Atoms	39
Complexity	1348.381

Chemical Identifiers

CAS Number	301655-50-5
SMILES	CCOC1=CC2=C(C=C1)NC(C3=C2C4(C(=C(S3)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)(C)C