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Home > Indoles and Oxindole > 876733-19-6
876733-19-6 | 1H-Indole-3-carbonitrile, 1-ethyl-6-(pyrazinyloxy)-
CAS No: 876733-19-6 Catalog No: AG004KFJ MDL No:
Product Description
Catalog Number:
AG004KFJ
Chemical Name:
1H-Indole-3-carbonitrile, 1-ethyl-6-(pyrazinyloxy)-
CAS Number:
876733-19-6
Molecular Formula:
C15H12N4O
Molecular Weight:
264.2820
IUPAC Name:
1-ethyl-6-pyrazin-2-yloxyindole-3-carbonitrile
InChI:
InChI=1S/C15H12N4O/c1-2-19-10-11(8-16)13-4-3-12(7-14(13)19)20-15-9-17-5-6-18-15/h3-7,9-10H,2H2,1H3
InChI Key:
GGSBXXYFGVAKHD-UHFFFAOYSA-N
SMILES:
N#Cc1cn(c2c1ccc(c2)Oc1cnccn1)CC
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.101g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.288g/mol
Monoisotopic Mass:
264.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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