AC1ME4HB

tetramethyl 5',5',9'-trimethyl-6'-propanoylspiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate

Also Known As: ChemDiv1_022619|DivK1c_003883|HMS651E03|CDS1_002843|BAS 00416449|AG-690/36749026|SR-01000449709-1|tetramethyl 5',5',9'-trimethyl-6'-propanoylspiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate|tetramethyl 5',5',9'-trimethyl-6'-propanoyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate|2',3',4,5-TETRAMETHYL 5',5',9'-TRIMETHYL-6'-PROPANOYL-5',6'-DIHYDROSPIRO[1,3-DITHIOLE-2,1'-THIOPYRANO[2,3-C]QUINOLINE]-2',3',4,5-TETRACARBOXYLATE|2',3',4,5-TETRAMETHYL 5',5',9'-TRIMETHYL-6'-PROPANOYLSPIRO[1,3-DITHIOLE-2,1'-THIOPYRANO[2,3-C]QUINOLINE]-2',3',4,5-TETRACARBOXYLATE|tetramethyl 5',5',9'-trimethyl-6'-propionyl-5',6'-dihydrospiro(1,3-dithiole-2,1'-[1'H]-thiopyrano[2,3-c]quinoline)-2',3',4,5-tetracarboxylate|tetramethyl 5',5',9'-trimethyl-6'-propionyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate

Molecular Formula	C28H29NO9S3
Molecular Weight	619.10046 g/mol
LogP	4.32212
Topological Polar Surface Area	125.51 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	12
Rotatable Bonds	5
Exact Mass	619.10046
Monoisotopic Mass	619.10046
Heavy Atoms	41
Complexity	1460.1372

Chemical Identifiers

CAS Number	328069-39-2
SMILES	CCC(=O)N1C2=C(C=C(C=C2)C)C3=C(C1(C)C)SC(=C(C34SC(=C(S4)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC