Home Aminos 6-amino-2-(4-methoxyphenyl)pyrimidin-4(3H)-one

6-amino-2-(4-methoxyphenyl)pyrimidin-4(3H)-one

CAS No.:
1154345-57-9
Catalog Number:
AG00J926
Molecular Formula:
C11H11N3O2
Molecular Weight:
217.2239
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Product Description
Catalog Number:
AG00J926
Chemical Name:
6-amino-2-(4-methoxyphenyl)pyrimidin-4(3H)-one
CAS Number:
1154345-57-9
Molecular Formula:
C11H11N3O2
Molecular Weight:
217.2239
MDL Number:
MFCD12189042
IUPAC Name:
6-amino-2-(4-methoxyphenyl)-1,3-diazinan-4-one
InChI:
InChI=1S/C11H15N3O2/c1-16-8-4-2-7(3-5-8)11-13-9(12)6-10(15)14-11/h2-5,9,11,13H,6,12H2,1H3,(H,14,15)
InChI Key:
YATCYXSRXYFFOD-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1nc(N)cc(=O)[nH]1
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.116g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
221.26g/mol
Monoisotopic Mass:
221.116g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties