Chem Tetraphenyl Dipropyleneglycol

Compound 14
  CheckMol                        TMF02:r0:m0
MF=C30H30O3 MW=438.57
 33 36  0  4  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3359   -0.7582   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3119   -0.7582   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6719    0.0120   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3480   -2.2747   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6237    0.0120   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0078   -0.7462   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6117   -1.5044   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6117    1.5526   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.9356   -0.7462   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9236    2.3228   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2758    2.3349   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.2475    0.0241   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.9236   -2.2627   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.2475   -1.5044   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.9115    3.8634   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2637    3.8754   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.7398   -0.3851   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.2354    1.5646   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5876   -3.0089   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    4.8503   -3.0209   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.4280   -2.9968   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.4871   -0.9027   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5756    4.6336   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    7.8712    0.0481   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.5473    2.3349   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5756   -4.5253   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.2234   -4.5374   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.5473   -3.7671   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    7.8712   -1.4804   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    7.8591    1.5887   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8874   -5.2836   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    7.8591   -2.9968   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6 10  1  0  0  0  0
  9 11 02  0  1  0  0
  9 12 01  0  1  0  0
 10 13  1  0  0  0  0
 10 14  1  0  0  0  0
 10 15  1  0  0  0  0
 11 16 01  0  1  0  0
 12 17 02  0  1  0  0
 13 18 02  0  1  0  0
 13 19 01  0  1  0  0
 14 20 02  0  1  0  0
 14 21 01  0  1  0  0
 15 22 02  0  1  0  0
 15 23 01  0  1  0  0
 16 24 02  0  1  0  0
 18 25 01  0  1  0  0
 19 26 02  0  1  0  0
 20 27 01  0  1  0  0
 21 28 02  0  1  0  0
 22 29 01  0  1  0  0
 23 30 02  0  1  0  0
 25 31 02  0  1  0  0
 27 32 02  0  1  0  0
 29 33 02  0  1  0  0
 17 24 01  0  1  0  0
 26 31 01  0  1  0  0
 28 32 01  0  1  0  0
 30 33 01  0  1  0  0
M  END

Tetraphenyl dipropyleneglycol

₹ 0.00 0.00

Property Name	Property Value
Mol Name	Tetraphenyl dipropyleneglycol
Molweight	438.565
Monoisotopic Mass	438.219495
Clogp	5.2642
Clogs	-5.095
H Acceptors	3
H Donors	2
Total Surface Area	348.34
Relative Psa	0.10392
Polar Surface Area	49.69
Druglikeness	-1.0175
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.33333
Molecular Flexibility	0.47664
Molecular Complexity	0.77872
Fragments	1
Non H Atoms	33
Non Ch Atoms	3
Electronegative Atoms	3
Stereo Centers	2
Rotatable Bonds	9
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3 Atoms	9
Symmetric Atoms	16
Smiles	CC(CO)OCC(C(c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)O

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Tetraphenyl dipropyleneglycol