Chemical Properties of Isonipecotinoylisonipecotic acid, N'-(3,4-difluorobenzoyl)-, ethyl ester

Isonipecotinoylisonipecotic acid, N'-(3,4-difluorobenzoyl)-, ethyl ester

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InChI
InChI=1S/C21H26F2N2O4/c1-2-29-21(28)15-7-11-24(12-8-15)19(26)14-5-9-25(10-6-14)20(27)16-3-4-17(22)18(23)13-16/h3-4,13-15H,2,5-12H2,1H3
InChI Key
WBKCNUKHXRKCBH-UHFFFAOYSA-N
Formula
C21H26F2N2O4
SMILES
CCOC(=O)C1CCN(C(=O)C2CCN(C(=O)c3ccc(F)c(F)c3)CC2)CC1
Molecular Weight1
408.44
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Physical Properties

Property Value Unit Source
log10WS -3.82 Crippen Calculated Property
logPoct/wat 2.619 Crippen Calculated Property
McVol 295.350 ml/mol McGowan Calculated Property
Inp [3361.00; 3361.00]   Show Hide
Inp 3361.00 NIST
Inp 3361.00 NIST

Similar Compounds

Isonipecotinoylisonipecotic acid, N'-(3,4-difluorobenzoyl)-, propyl ester. Isonipecotinoylisonipecotic acid, N'-(3,4-difluorobenzoyl)-, isobutyl ester. Isonipecotinoylisonipecotic acid, N'-(2,4-difluorobenzoyl)-, ethyl ester. Isonipecotinoylisonipecotic acid, N'-(2,4-difluorobenzoyl)-, propyl ester. Isonipecotinoylisonipecotic acid, N'-(2-fluoro-5-trifluoromethylbenzoyl)-, ethyl ester. Isonipecotinoylisonipecotic acid, N'-(2,5-difluorobenzoyl)-, ethyl ester. Isonipecotic acid, N-(3,4-difluorobenzoyl)-, ethyl ester. Isonipecotinoylisonipecotic acid, N'-(2,5-difluorobenzoyl)-, propyl ester. Isonipecotinoylisonipecotic acid, N'-(3-fluoro-4-trifluoromethylbenzoyl)-, propyl ester. Isonipecotinoylisonipecotic acid, N'-(2-fluoro-5-trifluoromethylbenzoyl)-, propyl ester. Isonipecotinoylisonipecotic acid, N'-(3-fluoro-4-trifluoromethylbenzoyl)-, butyl ester. Isonipecotinoylisonipecotic acid, N'-(2,5-difluorobenzoyl)-, isobutyl ester. Isonipecotic acid, N-(3,4-difluorobenzoyl)-, butyl ester. Isonipecotic acid, N-(3,4-difluorobenzoyl)-, isobutyl ester. Isonipecotinoylisonipecotic acid, N'-(2-fluoro-5-trifluoromethylbenzoyl)-, butyl ester.

Find more compounds similar to Isonipecotinoylisonipecotic acid, N'-(3,4-difluorobenzoyl)-, ethyl ester.

Sources

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