Chemical ID: 6335272

COc1ccc(cc1)NC(=O)CCCCCCCCCCC(=O)Nc2ccc(cc2)OC
Chemical ID:
6335272
Name [?]:
N,N'-bis(4-methoxyphenyl)dodecanediamide
SMILES [?]:
COc1ccc(cc1)NC(=O)CCCCCCCCCCC(=O)Nc2ccc(cc2)OC
InChi [?]:
InChI=1/C26H36N2O4/c1-31-23-17-13-21(14-18-23)27-25(29)11-9-7-5-3-4-6-8-10-12-26(30)28-22-15-19-24(32-2)20-16-22/h13-20H,3-12H2,1-2H3,(H,27,29)(H,28,30)
InChi Info:
AuxInfo=1/1/N:1,32,16,17,15,18,14,19,13,20,12,21,5,7,26,30,4,8,27,29,6,25,3,28,10,22,9,24,11,23,2,31/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14,15,16)(17,18,19,20)(21,22)(23,24)(25,26)(27,28)(29,30)(31,32)/gE:(1,2)/rA:32nCOCCCCCCNCOCCCCCCCCCCCONCCCCCCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;s12;s13;s14;s15;s16;s17;s18;s19;s20;s21;d22;s22;s24;s25;d26;s27;d28;d25s29;s28;s31;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C26H36N2O4
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:13.2417
Area:768.921
Solvation:-5.9813
Coulombic:-55.3814
Bond Count [?]
All:33
Single:25
Double:8
Rotors:17
Chiral:0
Rigid Segments:11
Chemical Properties
Molecular Weight:440.575
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:5.96
LogP (Chemaxon):5.37

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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