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433697-67-7

433697-67-7 structural image
Product Name: 3-[[[[(3-METHOXY-2-NAPHTHALENYL)CARBONYL]AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID
Formula: C21H18N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 394.4 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 394.09872823 g/mol
Monoisotopic Mass 394.09872823 g/mol
Topological Polar Surface Area 120 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 599
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes