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202916-71-0 | 2,4(1H,3H)-Pyrimidinedione, 5-methyl-6-(4-morpholinyl)-
CAS No: 202916-71-0 Catalog No: AG0028JR MDL No:
Product Description
Catalog Number:
AG0028JR
Chemical Name:
2,4(1H,3H)-Pyrimidinedione, 5-methyl-6-(4-morpholinyl)-
CAS Number:
202916-71-0
Molecular Formula:
C9H13N3O3
Molecular Weight:
211.2178
IUPAC Name:
5-methyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione
InChI:
InChI=1S/C9H13N3O3/c1-6-7(10-9(14)11-8(6)13)12-2-4-15-5-3-12/h2-5H2,1H3,(H2,10,11,13,14)
InChI Key:
YIBABBLDPCFUBU-UHFFFAOYSA-N
SMILES:
O=c1[nH]c(=O)c(c([nH]1)N1CCOCC1)C
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.096g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.221g/mol
Monoisotopic Mass:
211.096g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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