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Home > Indoles and Oxindole > 1586-48-7
1586-48-7 | Isoquinoline, 1-[2-(1H-indol-3-yl)ethenyl]-
CAS No: 1586-48-7 Catalog No: AG001QBZ MDL No:
Product Description
Catalog Number:
AG001QBZ
Chemical Name:
Isoquinoline, 1-[2-(1H-indol-3-yl)ethenyl]-
CAS Number:
1586-48-7
Molecular Formula:
C19H14N2
Molecular Weight:
270.3279
IUPAC Name:
1-[2-(1H-indol-3-yl)ethenyl]isoquinoline
InChI:
InChI=1S/C19H14N2/c1-2-6-16-14(5-1)11-12-20-19(16)10-9-15-13-21-18-8-4-3-7-17(15)18/h1-13,21H
InChI Key:
GXWLLYOLXFYXAT-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)ccnc2C=Cc1c[nH]c2c1cccc2
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.116g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.335g/mol
Monoisotopic Mass:
270.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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