Home Other Building Blocks 5-Chloro-6-methyl-2-(pyridin-4-yl)pyrimidin-4-ol

5-Chloro-6-methyl-2-(pyridin-4-yl)pyrimidin-4-ol

CAS No.:
1239786-71-0
Catalog Number:
AG01DXFE
Molecular Formula:
C10H8ClN3O
Molecular Weight:
221.6430
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Product Description
Catalog Number:
AG01DXFE
Chemical Name:
5-Chloro-6-methyl-2-(pyridin-4-yl)pyrimidin-4-ol
CAS Number:
1239786-71-0
Molecular Formula:
C10H8ClN3O
Molecular Weight:
221.6430
MDL Number:
MFCD16872738
IUPAC Name:
5-chloro-4-methyl-2-pyridin-4-yl-1H-pyrimidin-6-one
InChI:
InChI=1S/C10H8ClN3O/c1-6-8(11)10(15)14-9(13-6)7-2-4-12-5-3-7/h2-5H,1H3,(H,13,14,15)
InChI Key:
HHKYLSJWYJQBIS-UHFFFAOYSA-N
SMILES:
Cc1nc([nH]c(=O)c1Cl)c1ccncc1
Properties
Complexity:
343  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.036g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.644g/mol
Monoisotopic Mass:
221.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties