Mrv1652306031606382D          

 52 53  0  0  0  0            999 V2000
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   13.5749    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0026    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -8.5737    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7145    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -7.1447    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.4302    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
> <DATABASE_ID>
CHEM043148

> <DATABASE_NAME>
chemdb

> <SMILES>
CCCCCCCCON1C(C)(C)CCC(OC(=O)CCCCCCCCC(=O)OC2CCC(C)(C)N(OCCCCCCCC)C2(C)C)C1(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C44H84N2O6/c1-11-13-15-17-23-27-35-49-45-41(3,4)33-31-37(43(45,7)8)51-39(47)29-25-21-19-20-22-26-30-40(48)52-38-32-34-42(5,6)46(44(38,9)10)50-36-28-24-18-16-14-12-2/h37-38H,11-36H2,1-10H3

> <INCHI_KEY>
NLMFVJSIGDIJBB-UHFFFAOYSA-N

> <FORMULA>
C44H84N2O6

> <MOLECULAR_WEIGHT>
737.164

> <EXACT_MASS>
736.632938433

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_ATOM_COUNT>
136

> <JCHEM_AVERAGE_POLARIZABILITY>
94.22333033421341

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
bis[2,2,6,6-tetramethyl-1-(octyloxy)piperidin-3-yl] decanedioate

> <ALOGPS_LOGP>
9.41

> <JCHEM_LOGP>
11.748219428666665

> <ALOGPS_LOGS>
-7.43

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
2.621896198287661

> <JCHEM_POLAR_SURFACE_AREA>
77.54000000000002

> <JCHEM_REFRACTIVITY>
213.8294

> <JCHEM_ROTATABLE_BOND_COUNT>
29

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.75e-05 g/l

> <JCHEM_TRADITIONAL_IUPAC>
bis[2,2,6,6-tetramethyl-1-(octyloxy)piperidin-3-yl] decanedioate

> <JCHEM_VEBER_RULE>
0

> <NAME>
bis(2,2,6,6-tetramethyl-1-octyloxypiperidin-4-yl)-1,10-decanedioate

> <CAS>
122586-52-1

$$$$