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338407-86-6

338407-86-6 structural image
Product Name: N-(4-CHLOROPHENYL)-3-NITRO-4-(1H-1,2,4-TRIAZOL-1-YL)BENZENECARBOXAMIDE
Formula: C15H10ClN5O3
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COMPUTED DESCRIPTORS

Molecular Weight 343.72 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 343.0472169 g/mol
Monoisotopic Mass 343.0472169 g/mol
Topological Polar Surface Area 106 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 467
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