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Home > Imidazoles > 88710-33-2
88710-33-2 | 1H-Imidazo[4,5-b]pyrazine, 2-[2-methoxy-4-(2-propynyloxy)phenyl]-
CAS No: 88710-33-2 Catalog No: AG0089CQ MDL No:
Product Description
Catalog Number:
AG0089CQ
Chemical Name:
1H-Imidazo[4,5-b]pyrazine, 2-[2-methoxy-4-(2-propynyloxy)phenyl]-
CAS Number:
88710-33-2
Molecular Formula:
C15H12N4O2
Molecular Weight:
280.2814
IUPAC Name:
2-(2-methoxy-4-prop-2-ynoxyphenyl)-1H-imidazo[4,5-b]pyrazine
InChI:
InChI=1S/C15H12N4O2/c1-3-8-21-10-4-5-11(12(9-10)20-2)13-18-14-15(19-13)17-7-6-16-14/h1,4-7,9H,8H2,2H3,(H,16,17,18,19)
InChI Key:
UIOGVZFAFGURAI-UHFFFAOYSA-N
SMILES:
C#CCOc1ccc(c(c1)OC)c1nc2c([nH]1)nccn2
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.096g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
280.287g/mol
Monoisotopic Mass:
280.096g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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