Home Halogens 6-amino-1-[(4-chlorophenyl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

6-amino-1-[(4-chlorophenyl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

CAS No.:
179486-47-6
Catalog Number:
AG019Y44
Molecular Formula:
C11H10ClN3O2
Molecular Weight:
251.6690
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Product Description
Catalog Number:
AG019Y44
Chemical Name:
6-amino-1-[(4-chlorophenyl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
CAS Number:
179486-47-6
Molecular Formula:
C11H10ClN3O2
Molecular Weight:
251.6690
MDL Number:
MFCD06260079
IUPAC Name:
6-amino-1-[(4-chlorophenyl)methyl]pyrimidine-2,4-dione
InChI:
InChI=1S/C11H10ClN3O2/c12-8-3-1-7(2-4-8)6-15-9(13)5-10(16)14-11(15)17/h1-5H,6,13H2,(H,14,16,17)
InChI Key:
HGWQNUBKCNLWAI-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)Cn1c(N)cc(=O)[nH]c1=O
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.046g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
251.67g/mol
Monoisotopic Mass:
251.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties