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202135-13-5

202135-13-5 structural image
Product Name: 1-ETHYL-2-[(3-([1-ETHYLNAPHTHO[1,2-D][1,3]THIAZOL-2(1H)-YLIDENE]METHYL)-2,5,5-TRIMETHYL-2-CYCLOHEXEN-1-YLIDENE)METHYL]NAPHTHO[1,2-D][1,3]THIAZOL-1-IUM 4-METHYLBENZENESULFONATE
Formula: C44H44N2O3S3
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COMPUTED DESCRIPTORS

Molecular Weight 745.0 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 744.25140679 g/mol
Monoisotopic Mass 744.25140679 g/mol
Topological Polar Surface Area 126 Ų
Heavy Atom Count 52
Formal Charge 0
Complexity 1190
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes