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1333466-52-6 | 2(1H)-Pyrimidinone, 6-[(2-furanylmethyl)amino]-5-(hydroxymethyl)-
CAS No: 1333466-52-6 Catalog No: AG0014PK MDL No:
Product Description
Catalog Number:
AG0014PK
Chemical Name:
2(1H)-Pyrimidinone, 6-[(2-furanylmethyl)amino]-5-(hydroxymethyl)-
CAS Number:
1333466-52-6
Molecular Formula:
C10H11N3O3
Molecular Weight:
221.2126
IUPAC Name:
6-(furan-2-ylmethylamino)-5-(hydroxymethyl)-1H-pyrimidin-2-one
InChI:
InChI=1S/C10H11N3O3/c14-6-7-4-12-10(15)13-9(7)11-5-8-2-1-3-16-8/h1-4,14H,5-6H2,(H2,11,12,13,15)
InChI Key:
UOOVCMURVPTHAX-UHFFFAOYSA-N
SMILES:
OCc1cnc(=O)[nH]c1NCc1ccco1
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
221.216g/mol
Monoisotopic Mass:
221.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
Literature
| Title | Journal |
|---|---|
| New cytosine derivatives as inhibitors of DNA methylation. | European journal of medicinal chemistry 20120901 |
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