AC1MP5X6 structure

AC1MP5X6

7-O-ethyl 2-O-methyl 4-(4-bromophenyl)-8-methyl-9-phenyl-1,6-dithia-3,4,9-triazaspiro[4.4]nona-2,7-diene-2,7-dicarboxylate

Also Known As: 7-ethyl 3-methyl 1-(4-bromophenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate|3-O-ethyl 8-O-methyl 6-(4-bromophenyl)-2-methyl-1-phenyl-4,9-dithia-1,6,7-triazaspiro[4.4]nona-2,7-diene-3,8-dicarboxylate

CAS: 670263-75-9
Molecular Formula C22H20BrN3O4S2
Molecular Weight 533.0079 g/mol
LogP 5.1481
Topological Polar Surface Area 71.44 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 9
Rotatable Bonds 5
Exact Mass 533.0079
Monoisotopic Mass 533.0079
Heavy Atoms 32
Complexity 1107.9188

Chemical Identifiers

CAS Number 670263-75-9
SMILES CCOC(=O)C1=C(N(C2(S1)N(N=C(S2)C(=O)OC)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C

Product Overview

AC1MP5X6 (CAS 670263-75-9), with molecular formula C22H20BrN3O4S2 and molecular weight 533.0079 g/mol. IUPAC: 7-O-ethyl 2-O-methyl 4-(4-bromophenyl)-8-methyl-9-phenyl-1,6-dithia-3,4,9-triazaspiro[4.4]nona-2,7-diene-2,7-dicarboxylate.

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