Home Halogens 2-(2-chloropyridin-4-yl)-5,6-dimethyl-1,4-dihydropyrimidin-4-one

2-(2-chloropyridin-4-yl)-5,6-dimethyl-1,4-dihydropyrimidin-4-one

CAS No.:
1258650-00-8
Catalog Number:
AG01AAYL
Molecular Formula:
C11H10ClN3O
Molecular Weight:
235.6696
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Product Description
Catalog Number:
AG01AAYL
Chemical Name:
2-(2-chloropyridin-4-yl)-5,6-dimethyl-1,4-dihydropyrimidin-4-one
CAS Number:
1258650-00-8
Molecular Formula:
C11H10ClN3O
Molecular Weight:
235.6696
MDL Number:
MFCD26143907
IUPAC Name:
2-(2-chloropyridin-4-yl)-4,5-dimethyl-1H-pyrimidin-6-one
InChI:
InChI=1S/C11H10ClN3O/c1-6-7(2)14-10(15-11(6)16)8-3-4-13-9(12)5-8/h3-5H,1-2H3,(H,14,15,16)
InChI Key:
PAIRXQOMYHXSSQ-UHFFFAOYSA-N
SMILES:
Clc1nccc(c1)c1nc(=O)c(c([nH]1)C)C
Properties
Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.671g/mol
Monoisotopic Mass:
235.051g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties