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Home > Quinoline > 189141-31-9
189141-31-9 | Quinoline, 8-[3-[4-(phenylmethyl)-1-piperazinyl]propoxy]-
CAS No: 189141-31-9 Catalog No: AG002HYA MDL No:
Product Description
Catalog Number:
AG002HYA
Chemical Name:
Quinoline, 8-[3-[4-(phenylmethyl)-1-piperazinyl]propoxy]-
CAS Number:
189141-31-9
Molecular Formula:
C23H27N3O
Molecular Weight:
361.4800
IUPAC Name:
8-[3-(4-benzylpiperazin-1-yl)propoxy]quinoline
InChI:
InChI=1S/C23H27N3O/c1-2-7-20(8-3-1)19-26-16-14-25(15-17-26)13-6-18-27-22-11-4-9-21-10-5-12-24-23(21)22/h1-5,7-12H,6,13-19H2
InChI Key:
PKSMOCBMTRBBOC-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN1CCN(CC1)CCCOc1cccc2c1nccc2
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.215g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.489g/mol
Monoisotopic Mass:
361.215g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
28.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Synthesis and evaluation of 1-(quinoliloxypropyl)-4-aryl piperazines for atypical antipsychotic effect. | Bioorganic & medicinal chemistry letters 20090601 |
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