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1420206-23-0 | 1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-bromo-, hydrazide
CAS No: 1420206-23-0 Catalog No: AG001HK5 MDL No:
Product Description
Catalog Number:
AG001HK5
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-bromo-, hydrazide
CAS Number:
1420206-23-0
Molecular Formula:
C8H7BrN4O
Molecular Weight:
255.0714
IUPAC Name:
5-bromo-1H-pyrrolo[2,3-b]pyridine-2-carbohydrazide
InChI:
InChI=1S/C8H7BrN4O/c9-5-1-4-2-6(8(14)13-10)12-7(4)11-3-5/h1-3H,10H2,(H,11,12)(H,13,14)
InChI Key:
ZBMXAUVZSHODEU-UHFFFAOYSA-N
SMILES:
NNC(=O)c1cc2c([nH]1)ncc(c2)Br
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.98g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
255.075g/mol
Monoisotopic Mass:
253.98g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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