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433701-29-2

433701-29-2 structural image
Product Name: 2-[[5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(2-hydroxyethoxy)ethyl]acetamide
Formula: C17H21N5O3S3
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COMPUTED DESCRIPTORS

Molecular Weight 439.6 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 11
Exact Mass 439.08065307 g/mol
Monoisotopic Mass 439.08065307 g/mol
Topological Polar Surface Area 181 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 493
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