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321431-09-8

321431-09-8 structural image
Product Name: N-(4-CHLOROPHENYL)-5-METHYL-1-(4-NITROPHENYL)-1H-1,2,4-TRIAZOLE-3-CARBOXAMIDE
Formula: C16H12ClN5O3
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COMPUTED DESCRIPTORS

Molecular Weight 357.75 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 357.0628670 g/mol
Monoisotopic Mass 357.0628670 g/mol
Topological Polar Surface Area 106 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 487
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

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