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Home > Quinoline > 584555-10-2
584555-10-2 | Quinoline, 2-Methyl-5-[2-[4-(8-quinolinylMethyl)-1-piperazinyl]ethoxy]-
CAS No: 584555-10-2 Catalog No: AG00EJ2W MDL No:MFCD19982820
Product Description
Catalog Number:
AG00EJ2W
Chemical Name:
Quinoline, 2-Methyl-5-[2-[4-(8-quinolinylMethyl)-1-piperazinyl]ethoxy]-
CAS Number:
584555-10-2
MDL Number:
MFCD19982820
IUPAC Name:
2-methyl-5-[2-[4-(quinolin-8-ylmethyl)piperazin-1-yl]ethoxy]quinoline
InChI:
InChI=1S/C26H28N4O/c1-20-10-11-23-24(28-20)8-3-9-25(23)31-18-17-29-13-15-30(16-14-29)19-22-6-2-5-21-7-4-12-27-26(21)22/h2-12H,13-19H2,1H3
InChI Key:
RMCSKUADBRROSI-UHFFFAOYSA-N
Properties
Complexity:
552
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
412.226g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
412.537g/mol
Monoisotopic Mass:
412.226g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Literature
| Title | Journal |
|---|---|
| Discovery of potent, orally bioavailable, selective 5-HT1A/B/D receptor antagonists. | Journal of medicinal chemistry 20080522 |
| Discovery of the first potent, selective 5-hydroxytryptamine1D receptor antagonist. | Journal of medicinal chemistry 20050519 |
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