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1084893-56-0

1084893-56-0 structural image
Product Name: (S)-CR8
Formula: C24H29N7O
Synonyms: 2-(S)-(1-Ethyl-2-hydroxyethylamino)-6-(4-(2-pyridyl)benzyl)-9-isopropylpurine, (S)-CR8;CR8, (S)-Isomer - CAS 1084893-56-0 - Calbiochem
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COMPUTED DESCRIPTORS

Molecular Weight 431.5 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 9
Exact Mass 431.24335857 g/mol
Monoisotopic Mass 431.24335857 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 557
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
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

(2S)-2-[[9-propan-2-yl-6-[[4-(2-pyridinyl)phenyl]methylamino]-2-purinyl]amino]-1-butanol is a phenylpyridine.