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1394119-33-5 | 2-Pyrimidinamine, 4-(6-bromo-1H-indazol-1-yl)-
CAS No: 1394119-33-5 Catalog No: AG001AZ1 MDL No:
Product Description
Catalog Number:
AG001AZ1
Chemical Name:
2-Pyrimidinamine, 4-(6-bromo-1H-indazol-1-yl)-
CAS Number:
1394119-33-5
Molecular Formula:
C11H8BrN5
Molecular Weight:
290.1187
IUPAC Name:
4-(6-bromoindazol-1-yl)pyrimidin-2-amine
InChI:
InChI=1S/C11H8BrN5/c12-8-2-1-7-6-15-17(9(7)5-8)10-3-4-14-11(13)16-10/h1-6H,(H2,13,14,16)
InChI Key:
JHXRSKBXDLFFQA-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)n(nc2)c1ccnc(n1)N
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.996g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.124g/mol
Monoisotopic Mass:
288.996g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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