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1190309-87-5 | 1H-Pyrrolo[2,3-b]pyridin-5-amine, 3-iodo-
CAS No: 1190309-87-5 Catalog No: AG000P2Y MDL No:
Product Description
Catalog Number:
AG000P2Y
Chemical Name:
1H-Pyrrolo[2,3-b]pyridin-5-amine, 3-iodo-
CAS Number:
1190309-87-5
Molecular Formula:
C7H6IN3
Molecular Weight:
259.0471
IUPAC Name:
3-iodo-1H-pyrrolo[2,3-b]pyridin-5-amine
InChI:
InChI=1S/C7H6IN3/c8-6-3-11-7-5(6)1-4(9)2-10-7/h1-3H,9H2,(H,10,11)
InChI Key:
PCWAEJNYZMRVSH-UHFFFAOYSA-N
SMILES:
Nc1cnc2c(c1)c(I)c[nH]2
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.961g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
259.05g/mol
Monoisotopic Mass:
258.961g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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