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89231-42-5 | Piperazine, 1-(1-oxo-2-phenylpropyl)-4-pyrazinyl-
CAS No: 89231-42-5 Catalog No: AG0044GF MDL No:
Product Description
Catalog Number:
AG0044GF
Chemical Name:
Piperazine, 1-(1-oxo-2-phenylpropyl)-4-pyrazinyl-
CAS Number:
89231-42-5
Molecular Formula:
C17H20N4O
Molecular Weight:
296.3669
IUPAC Name:
2-phenyl-1-(4-pyrazin-2-ylpiperazin-1-yl)propan-1-one
InChI:
InChI=1S/C17H20N4O/c1-14(15-5-3-2-4-6-15)17(22)21-11-9-20(10-12-21)16-13-18-7-8-19-16/h2-8,13-14H,9-12H2,1H3
InChI Key:
LQFWSSZSWKQUAY-UHFFFAOYSA-N
SMILES:
O=C(C(c1ccccc1)C)N1CCN(CC1)c1cnccn1
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.164g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.374g/mol
Monoisotopic Mass:
296.164g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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