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1193-22-2 | 4(3H)-Pyrimidinone, 6-amino-
CAS No: 1193-22-2 Catalog No: AG000IJA MDL No:MFCD00051502
Product Description
Catalog Number:
AG000IJA
Chemical Name:
4(3H)-Pyrimidinone, 6-amino-
CAS Number:
1193-22-2
Molecular Formula:
C4H5N3O
Molecular Weight:
111.1020
MDL Number:
MFCD00051502
IUPAC Name:
4-amino-1H-pyrimidin-6-one
InChI:
InChI=1S/C4H5N3O/c5-3-1-4(8)7-2-6-3/h1-2H,(H3,5,6,7,8)
InChI Key:
HFMLLTVIMFEQRE-UHFFFAOYSA-N
SMILES:
Nc1nc[nH]c(=O)c1
EC Number:
214-771-8
NSC Number:
19868
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.043g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
111.104g/mol
Monoisotopic Mass:
111.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
Literature
| Title | Journal |
|---|---|
| 6-[2-(Phosphonomethoxy)alkoxy]pyrimidines with antiviral activity. | Journal of medicinal chemistry 20020425 |
| NO-independent regulatory site of direct sGC stimulators like YC-1 and BAY 41-2272. | BMC pharmacology 20010101 |
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