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19909-06-9 | Ethanone, 1-(4-cyclopentylphenyl)-2-(4-methyl-1-piperazinyl)-
CAS No: 19909-06-9 Catalog No: AG002BW2 MDL No:
Product Description
Catalog Number:
AG002BW2
Chemical Name:
Ethanone, 1-(4-cyclopentylphenyl)-2-(4-methyl-1-piperazinyl)-
CAS Number:
19909-06-9
Molecular Formula:
C18H26N2O
Molecular Weight:
286.4118
IUPAC Name:
1-(4-cyclopentylphenyl)-2-(4-methylpiperazin-1-yl)ethanone
InChI:
InChI=1S/C18H26N2O/c1-19-10-12-20(13-11-19)14-18(21)17-8-6-16(7-9-17)15-4-2-3-5-15/h6-9,15H,2-5,10-14H2,1H3
InChI Key:
LBQKSSNZFPMEQF-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)CC(=O)c1ccc(cc1)C1CCCC1
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.205g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.419g/mol
Monoisotopic Mass:
286.205g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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