Home Other Building Blocks 4-Chloro-6-(piperidin-1-yl)pyrimidin-2-amine

4-Chloro-6-(piperidin-1-yl)pyrimidin-2-amine

CAS No.:
104637-64-1
Catalog Number:
AG008RXF
Molecular Formula:
C9H13ClN4
Molecular Weight:
212.6793
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$791
- +
5g
1 week
United States
$3424
- +
10g
1 week
United States
$5456
- +
25g
1 week
United States
$9519
- +
Product Description
Catalog Number:
AG008RXF
Chemical Name:
4-Chloro-6-(piperidin-1-yl)pyrimidin-2-amine
CAS Number:
104637-64-1
Molecular Formula:
C9H13ClN4
Molecular Weight:
212.6793
MDL Number:
MFCD00664698
IUPAC Name:
4-chloro-6-piperidin-1-ylpyrimidin-2-amine
InChI:
InChI=1S/C9H13ClN4/c10-7-6-8(13-9(11)12-7)14-4-2-1-3-5-14/h6H,1-5H2,(H2,11,12,13)
InChI Key:
XXWWICKWOHZSQJ-UHFFFAOYSA-N
SMILES:
Clc1cc(nc(n1)N)N1CCCCC1
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.083g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.681g/mol
Monoisotopic Mass:
212.083g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Two polymorphs, with Z' = 1 and 2, of 2-amino-4-chloro-6-morpholinopyrimidine in P21/c, and 2-amino-4-chloro-6-piperidinopyrimidine, which is isomorphous and almost isostructural with the Z' = 2 polymorph. Acta crystallographica. Section C, Crystal structure communications 20030101
Properties