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862168-11-4 | 4-Chloro-6-(2-methoxyphenyl)-2-pyrimidinamine
CAS No: 862168-11-4 Catalog No: AG01FFPO MDL No:
Product Description
Catalog Number:
AG01FFPO
Chemical Name:
4-Chloro-6-(2-methoxyphenyl)-2-pyrimidinamine
CAS Number:
862168-11-4
IUPAC Name:
4-chloro-6-(2-methoxyphenyl)pyrimidin-2-amine
InChI:
InChI=1S/C11H10ClN3O/c1-16-9-5-3-2-4-7(9)8-6-10(12)15-11(13)14-8/h2-6H,1H3,(H2,13,14,15)
InChI Key:
SYQGHXNIIBJJKO-UHFFFAOYSA-N
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.051g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.671g/mol
Monoisotopic Mass:
235.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Optimization of potent, selective, and orally bioavailable pyrrolodinopyrimidine-containing inhibitors of heat shock protein 90. Identification of development candidate 2-amino-4-{4-chloro-2-[2-(4-fluoro-1H-pyrazol-1-yl)ethoxy]-6-methylphenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide. | Journal of medicinal chemistry 20110512 |
| Fragment-based drug discovery applied to Hsp90. Discovery of two lead series with high ligand efficiency. | Journal of medicinal chemistry 20100826 |
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