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16357-83-8 | 5-Pyrimidinecarboxaldehyde, 4-amino-
CAS No: 16357-83-8 Catalog No: AG001U8M MDL No:MFCD09991893
Product Description
Catalog Number:
AG001U8M
Chemical Name:
5-Pyrimidinecarboxaldehyde, 4-amino-
CAS Number:
16357-83-8
Molecular Formula:
C5H5N3O
Molecular Weight:
123.1127
MDL Number:
MFCD09991893
IUPAC Name:
4-aminopyrimidine-5-carbaldehyde
InChI:
InChI=1S/C5H5N3O/c6-5-4(2-9)1-7-3-8-5/h1-3H,(H2,6,7,8)
InChI Key:
PDZKNPQAPGGAFJ-UHFFFAOYSA-N
SMILES:
O=Cc1cncnc1N
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.043g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
123.115g/mol
Monoisotopic Mass:
123.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| 4-aminopyrimidine-5-carbaldehyde oximes as potent VEGFR-2 inhibitors. Part II. | Bioorganic & medicinal chemistry letters 20110315 |
| Discovery of novel 4-amino-6-arylaminopyrimidine-5-carbaldehyde oximes as dual inhibitors of EGFR and ErbB-2 protein tyrosine kinases. | Bioorganic & medicinal chemistry letters 20080615 |
| Synthesis and biological study of 4-aminopyrimidine-5-carboxaldehyde oximes as antiproliferative VEGFR-2 inhibitors. | Bioorganic & medicinal chemistry letters 20061201 |
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