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263276-45-5

263276-45-5 | 2-Pyrimidinamine, 4-chloro-6-(1-pyrrolidinyl)-

CAS No: 263276-45-5 Catalog No: AG002SQZ MDL No:MFCD00665930

Product Description

Catalog Number:
AG002SQZ
Chemical Name:
2-Pyrimidinamine, 4-chloro-6-(1-pyrrolidinyl)-
CAS Number:
263276-45-5
Molecular Formula:
C8H11ClN4
Molecular Weight:
198.6527
MDL Number:
MFCD00665930
IUPAC Name:
4-chloro-6-pyrrolidin-1-ylpyrimidin-2-amine
InChI:
InChI=1S/C8H11ClN4/c9-6-5-7(12-8(10)11-6)13-3-1-2-4-13/h5H,1-4H2,(H2,10,11,12)
InChI Key:
VYFKNMLIUPIVKM-UHFFFAOYSA-N
SMILES:
Clc1cc(nc(n1)N)N1CCCC1

Properties

Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.067g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.654g/mol
Monoisotopic Mass:
198.067g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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