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90125-58-9 | Piperazine, 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)-
CAS No: 90125-58-9 Catalog No: AG00H79B MDL No:
Product Description
Catalog Number:
AG00H79B
Chemical Name:
Piperazine, 1-[2-(5-ethyl-2-pyridinyl)ethyl]-4-(2-methoxyphenyl)-
CAS Number:
90125-58-9
Molecular Formula:
C20H27N3O
Molecular Weight:
325.4479
IUPAC Name:
1-[2-(5-ethylpyridin-2-yl)ethyl]-4-(2-methoxyphenyl)piperazine
InChI:
InChI=1S/C20H27N3O/c1-3-17-8-9-18(21-16-17)10-11-22-12-14-23(15-13-22)19-6-4-5-7-20(19)24-2/h4-9,16H,3,10-15H2,1-2H3
InChI Key:
GJBZRMPBLLNQKT-UHFFFAOYSA-N
SMILES:
CCc1ccc(nc1)CCN1CCN(CC1)c1ccccc1OC
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.215g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.456g/mol
Monoisotopic Mass:
325.215g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
28.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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