Chem 1 23 Dichloro Phenylpiperazine Hcl

Compound 47
  CheckMol                        TMF02:r0:m0
MF=C10H13Cl3N2 MW=267.59
 15 15  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2906    0.7578   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2788    2.2734   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5813    0.0118   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0355    3.0431   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.5694    3.0312   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5694   -1.4801   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8719    0.7696   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8601    2.2971   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2551   -2.2142   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8601   -2.2142   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2433   -3.7062   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8482   -3.7062   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5339   -4.4521   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5361   -0.3789   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 02  0  1  0  0
  2  4 01  0  1  0  0
  3  5  1  0  0  0  0
  3  6 01  0  1  0  0
  4  7  1  0  0  0  0
  4  8 02  0  1  0  0
  6  9 02  0  1  0  0
  7 10  1  0  1  0  0
  7 11  1  0  1  0  0
 10 12  1  0  1  0  0
 11 13  1  0  1  0  0
 12 14  1  0  1  0  0
  8  9 01  0  1  0  0
 13 14  1  0  1  0  0
M  END

1-(2,3-DICHLORO PHENYL)PIPERAZINE HCl

₹ 0.00 0.00

Chemical Name - 1-(2,3-DICHLORO PHENYL)PIPERAZINE HCl
Mol Weight - 231.125
Smiles - Clc(cccc1N2CCNCC2)c1Cl.Cl

Property Name	Property Value
Mol Name	1-(2,3-DICHLORO PHENYL)PIPERAZINE HCl
Molweight	231.125
Monoisotopic Mass	230.037752
Clogp	2.3971
Clogs	-3.055
H Acceptors	2
H Donors	1
Total Surface Area	167.4
Relative Psa	0.089665
Polar Surface Area	15.27
Druglikeness	2.845
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.57143
Molecular Flexibility	0.32856
Molecular Complexity	0.64751
Fragments	2
Non H Atoms	14
Non Ch Atoms	4
Electronegative Atoms	4
Rotatable Bonds	1
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	6
Symmetric Atoms	2
Amines	2
Alkyl Amines	1
Aromatic Amines	1
Basic Nitrogens	1
Smiles	Clc(cccc1N2CCNCC2)c1Cl.Cl
InChIKey

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1 - 1-(2,3-DICHLORO PHENYL)PIPERAZINE HCl
2 - 1-(2,3-DICHLORO PHENYL)PIPERAZINE HCl

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1-(2,3-DICHLORO PHENYL)PIPERAZINE HCl