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Home > Imidazoles > 14509-66-1
14509-66-1 | Imidazo[1,5-c]pyrimidin-5(6H)-one, 7,8-dihydro-
CAS No: 14509-66-1 Catalog No: AG001KKC MDL No:MFCD01443896
Product Description
Catalog Number:
AG001KKC
Chemical Name:
Imidazo[1,5-c]pyrimidin-5(6H)-one, 7,8-dihydro-
CAS Number:
14509-66-1
Molecular Formula:
C6H7N3O
Molecular Weight:
137.1393
MDL Number:
MFCD01443896
IUPAC Name:
7,8-dihydro-6H-imidazo[1,5-c]pyrimidin-5-one
InChI:
InChI=1S/C6H7N3O/c10-6-8-2-1-5-3-7-4-9(5)6/h3-4H,1-2H2,(H,8,10)
InChI Key:
AZFYLSFUALTNAY-UHFFFAOYSA-N
SMILES:
O=C1NCCc2n1cnc2
EC Number:
604-459-3
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.059g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
137.142g/mol
Monoisotopic Mass:
137.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
Literature
| Title | Journal |
|---|---|
| Structure based design of novel inhibitors for histidinol dehydrogenase from Geotrichum candidum. | Bioorganic & medicinal chemistry letters 20100701 |
| Dibromotyrosine and histamine derivatives from the tropical marine sponge Aplysina sp. | Natural product communications 20100301 |
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