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88710-46-7 | 1H-Imidazo[4,5-b]pyrazine, 2-(2,3,4-trimethoxyphenyl)-
CAS No: 88710-46-7 Catalog No: AG0045UL MDL No:
Product Description
Catalog Number:
AG0045UL
Chemical Name:
1H-Imidazo[4,5-b]pyrazine, 2-(2,3,4-trimethoxyphenyl)-
CAS Number:
88710-46-7
Molecular Formula:
C14H14N4O3
Molecular Weight:
286.2860
IUPAC Name:
2-(2,3,4-trimethoxyphenyl)-1H-imidazo[4,5-b]pyrazine
InChI:
InChI=1S/C14H14N4O3/c1-19-9-5-4-8(10(20-2)11(9)21-3)12-17-13-14(18-12)16-7-6-15-13/h4-7H,1-3H3,(H,15,16,17,18)
InChI Key:
XZJGLDUTPIIYOC-UHFFFAOYSA-N
SMILES:
COc1c(OC)ccc(c1OC)c1nc2c([nH]1)nccn2
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.107g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.291g/mol
Monoisotopic Mass:
286.107g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
82.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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