Home Halogens 6-amino-5-(2-chloroacetyl)-1-(2-methylpropyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

6-amino-5-(2-chloroacetyl)-1-(2-methylpropyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

CAS No.:
941190-92-7
Catalog Number:
AG019PPI
Molecular Formula:
C10H14ClN3O3
Molecular Weight:
259.6895
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Product Description
Catalog Number:
AG019PPI
Chemical Name:
6-amino-5-(2-chloroacetyl)-1-(2-methylpropyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
CAS Number:
941190-92-7
Molecular Formula:
C10H14ClN3O3
Molecular Weight:
259.6895
MDL Number:
MFCD09403606
IUPAC Name:
6-amino-5-(2-chloroacetyl)-1-(2-methylpropyl)pyrimidine-2,4-dione
InChI:
InChI=1S/C10H14ClN3O3/c1-5(2)4-14-8(12)7(6(15)3-11)9(16)13-10(14)17/h5H,3-4,12H2,1-2H3,(H,13,16,17)
InChI Key:
HHRJFISOYUHADD-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1c(=O)[nH]c(=O)n(c1N)CC(C)C
Properties
Complexity:
404  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.072g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
259.69g/mol
Monoisotopic Mass:
259.072g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
92.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties