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Chemical ID: 6669163

CCOc1ccccc1NC(=O)CCCCCCCCC(=O)Nc2ccccc2OCC

Chemical ID:

6669163

Name [?]:

N,N'-bis(2-ethoxyphenyl)decanediamide

SMILES [?]:

CCOc1ccccc1NC(=O)CCCCCCCCC(=O)Nc2ccccc2OCC

InChi [?]:

InChI=1/C26H36N2O4/c1-3-31-23-17-13-11-15-21(23)27-25(29)19-9-7-5-6-8-10-20-26(30)28-22-16-12-14-18-24(22)32-4-2/h11-18H,3-10,19-20H2,1-2H3,(H,27,29)(H,28,30)

InChi Info:

AuxInfo=1/1/N:1,32,2,31,16,17,15,18,14,19,7,26,6,27,8,25,5,28,13,20,9,24,4,29,11,21,10,23,12,22,3,30/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:32nCCOCCCCCCNCOCCCCCCCCCONCCCCCCOCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;d11;s11;s13;s14;s15;s16;s17;s18;s19;s20;d21;s21;s23;s24;d25;s26;d27;d24s28;s29;s30;s31;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₆H₃₆N₂O₄
All Atoms:	32
Heavy Atoms:	32
Chiral Atoms:	0

ZAP Information [?]

Total:	13.9501
Area:	766.751
Solvation:	-5.21871
Coulombic:	-57.7106

Bond Count [?]

All:	33
Single:	25
Double:	8
Rotors:	17
Chiral:	0
Rigid Segments:	10

Chemical Properties

Molecular Weight:	440.575
H-Bond Donors:	2
H-Bond Acceptors:	6
XLogP:	5.67
LogP (Chemaxon):	5.26

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value