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337920-93-1

337920-93-1 structural image
Product Name: DIMETHYL 5-(4-BROMOPHENYL)-2-OXO-2,3-DIHYDRO-1H-2LAMBDA4-PYRROLO[1,2-C][1,3]THIAZOLE-6,7-DICARBOXYLATE
Formula: C16H14BrNO5S
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COMPUTED DESCRIPTORS

Molecular Weight 412.3 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 410.97761 g/mol
Monoisotopic Mass 410.97761 g/mol
Topological Polar Surface Area 93.8 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 537
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes