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89007-11-4 | Piperazine, 1-[(3,4-dichlorophenyl)acetyl]-4-pyrazinyl-
CAS No: 89007-11-4 Catalog No: AG0044ZU MDL No:
Product Description
Catalog Number:
AG0044ZU
Chemical Name:
Piperazine, 1-[(3,4-dichlorophenyl)acetyl]-4-pyrazinyl-
CAS Number:
89007-11-4
Molecular Formula:
C16H16Cl2N4O
Molecular Weight:
351.2304
IUPAC Name:
2-(3,4-dichlorophenyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone
InChI:
InChI=1S/C16H16Cl2N4O/c17-13-2-1-12(9-14(13)18)10-16(23)22-7-5-21(6-8-22)15-11-19-3-4-20-15/h1-4,9,11H,5-8,10H2
InChI Key:
UNEPMCLCIXGMSM-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1cnccn1)Cc1ccc(c(c1)Cl)Cl
Properties
Complexity:
404
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.07g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
351.231g/mol
Monoisotopic Mass:
350.07g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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