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152460-10-1 | N-(5-Amino-2-methylphenyl)-4-(3-pyridyl)-2-pyrimidineamine
CAS No: 152460-10-1 Catalog No: AG003440 MDL No:MFCD09028125
Product Description
Catalog Number:
AG003440
Chemical Name:
N-(5-Amino-2-methylphenyl)-4-(3-pyridyl)-2-pyrimidineamine
CAS Number:
152460-10-1
Molecular Formula:
C16H15N5
Molecular Weight:
277.3238
MDL Number:
MFCD09028125
IUPAC Name:
4-methyl-3-N-(4-pyridin-3-ylpyrimidin-2-yl)benzene-1,3-diamine
InChI:
InChI=1S/C16H15N5/c1-11-4-5-13(17)9-15(11)21-16-19-8-6-14(20-16)12-3-2-7-18-10-12/h2-10H,17H2,1H3,(H,19,20,21)
InChI Key:
QGAIPGVQJVGBIA-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)Nc1nccc(n1)c1cccnc1)C
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.133g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
277.331g/mol
Monoisotopic Mass:
277.133g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| Nonaqueous capillary electrophoresis of imatinib mesylate and related substances. | Journal of separation science 20120801 |
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