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1784871-38-0 | 3H-Imidazo[4,5-b]pyridine, 5-bromo-2-methyl-3-(1-methylethyl)-
CAS No: 1784871-38-0 Catalog No: AG00262K MDL No:
Product Description
Catalog Number:
AG00262K
Chemical Name:
3H-Imidazo[4,5-b]pyridine, 5-bromo-2-methyl-3-(1-methylethyl)-
CAS Number:
1784871-38-0
Molecular Formula:
C10H12BrN3
Molecular Weight:
254.1264
IUPAC Name:
5-bromo-2-methyl-3-propan-2-ylimidazo[4,5-b]pyridine
InChI:
InChI=1S/C10H12BrN3/c1-6(2)14-7(3)12-8-4-5-9(11)13-10(8)14/h4-6H,1-3H3
InChI Key:
KARQRQWTKJYTON-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(n1)n(C(C)C)c(n2)C
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.021g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.131g/mol
Monoisotopic Mass:
253.021g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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