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2878-62-8 | Quinoline, 4-[2-(2,4,5-trimethoxyphenyl)ethenyl]-
CAS No: 2878-62-8 Catalog No: AG002WG5 MDL No:
Product Description
Catalog Number:
AG002WG5
Chemical Name:
Quinoline, 4-[2-(2,4,5-trimethoxyphenyl)ethenyl]-
CAS Number:
2878-62-8
Molecular Formula:
C20H19NO3
Molecular Weight:
321.3698
IUPAC Name:
4-[(E)-2-(2,4,5-trimethoxyphenyl)ethenyl]quinoline
InChI:
InChI=1S/C20H19NO3/c1-22-18-13-20(24-3)19(23-2)12-15(18)9-8-14-10-11-21-17-7-5-4-6-16(14)17/h4-13H,1-3H3/b9-8+
InChI Key:
XPYLMRIXEKTASO-CMDGGOBGSA-N
SMILES:
COc1cc(OC)c(cc1C=Cc1ccnc2c1cccc2)OC
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
321.136g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.376g/mol
Monoisotopic Mass:
321.136g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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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