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143999-83-1 | Ethanone, 2-(4-chlorophenoxy)-1-(1-piperazinyl)-
CAS No: 143999-83-1 Catalog No: AG001IQ8 MDL No:MFCD03446007
Product Description
Catalog Number:
AG001IQ8
Chemical Name:
Ethanone, 2-(4-chlorophenoxy)-1-(1-piperazinyl)-
CAS Number:
143999-83-1
Molecular Formula:
C12H15ClN2O2
Molecular Weight:
254.7127
MDL Number:
MFCD03446007
IUPAC Name:
2-(4-chlorophenoxy)-1-piperazin-1-ylethanone
InChI:
InChI=1S/C12H15ClN2O2/c13-10-1-3-11(4-2-10)17-9-12(16)15-7-5-14-6-8-15/h1-4,14H,5-9H2
InChI Key:
TYCJFZIWSCJVJW-UHFFFAOYSA-N
SMILES:
O=C(N1CCNCC1)COc1ccc(cc1)Cl
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.082g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.714g/mol
Monoisotopic Mass:
254.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Studies on the metabolism and the toxicological analysis of the nootropic drug fipexide in rat urine using gas chromatography-mass spectrometry. | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20040525 |
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