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199522-35-5

199522-35-5 structural image
Product Name: NNC 26-9100
Formula: C22H25BrCl2N6S
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COMPUTED DESCRIPTORS

Molecular Weight 556.3 g/mol
XLogP3 5.3
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 11
Exact Mass 554.04218 g/mol
Monoisotopic Mass 554.04218 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 563
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

PRODUCT INTRODUCTION

description

1-[3-[(5-bromo-2-pyridinyl)-[(3,4-dichlorophenyl)methyl]amino]propyl]-3-[3-(1H-imidazol-5-yl)propyl]thiourea is an aminopyridine.