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893727-09-8

893727-09-8 structural image
Product Name: 3H-1,2,4-Triazole-3-thione, 4-amino-5-(3-ethoxyphenyl)-2,4-dihydro-
Formula: C10H12N4OS
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COMPUTED DESCRIPTORS

Molecular Weight 236.30 g/mol
XLogP3 1.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 236.07318219 g/mol
Monoisotopic Mass 236.07318219 g/mol
Topological Polar Surface Area 95 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 307
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