1084893-56-0
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
Inquiry
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.