Home Other Building Blocks 1-(2,5-dimethoxyphenyl)-1,3-diazinan-2-one

1-(2,5-dimethoxyphenyl)-1,3-diazinan-2-one

CAS No.:
1140241-93-5
Catalog Number:
AG01ALDQ
Molecular Formula:
C12H16N2O3
Molecular Weight:
236.2670
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Product Description
Catalog Number:
AG01ALDQ
Chemical Name:
1-(2,5-dimethoxyphenyl)-1,3-diazinan-2-one
CAS Number:
1140241-93-5
Molecular Formula:
C12H16N2O3
Molecular Weight:
236.2670
MDL Number:
MFCD11870011
IUPAC Name:
1-(2,5-dimethoxyphenyl)-1,3-diazinan-2-one
InChI:
InChI=1S/C12H16N2O3/c1-16-9-4-5-11(17-2)10(8-9)14-7-3-6-13-12(14)15/h4-5,8H,3,6-7H2,1-2H3,(H,13,15)
InChI Key:
YJZYJZNNLWLLOA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1N1CCCNC1=O)OC
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.116g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.271g/mol
Monoisotopic Mass:
236.116g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties