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338418-77-2

338418-77-2 structural image
Product Name: N-(4-CHLOROPHENYL)-N'-[1-ETHOXY-2-(1H-1,2,4-TRIAZOL-1-YL)ETHYLIDENE]UREA
Formula: C13H14ClN5O2
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COMPUTED DESCRIPTORS

Molecular Weight 307.73 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 307.0836024 g/mol
Monoisotopic Mass 307.0836024 g/mol
Topological Polar Surface Area 81.4 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 372
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes