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Chemical ID: 7511345

c1ccc2c(c1)cccc2NC(=O)CCCCCCC(=O)Nc3cccc4c3cccc4

Chemical ID:

7511345

Name [?]:

N,N'-bis(1-naphthyl)octanediamide

SMILES [?]:

c1ccc2c(c1)cccc2NC(=O)CCCCCCC(=O)Nc3cccc4c3cccc4

InChi [?]:

InChI=1/C28H28N2O2/c31-27(29-25-17-9-13-21-11-5-7-15-23(21)25)19-3-1-2-4-20-28(32)30-26-18-10-14-22-12-6-8-16-24(22)26/h5-18H,1-4,19-20H2,(H,29,31)(H,30,32)

InChi Info:

AuxInfo=1/1/N:16,17,15,18,1,31,2,30,8,25,6,32,7,26,3,29,9,24,14,19,5,27,4,28,10,23,12,20,11,22,13,21/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:32nCCCCCCCCCCNCOCCCCCCCONCCCCCCCCCC/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;s11;d12;s12;s14;s15;s16;s17;s18;s19;d20;s20;s22;s23;d24;s25;d26;d23s27;s28;d29;s30;s27d31;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₈H₂₈N₂O₂
All Atoms:	60
Heavy Atoms:	32
Chiral Atoms:	None

ZAP Information [?]

Total:	13.7562
Area:	701.037
Solvation:	-3.7697
Coulombic:	-43.7345

Bond Count [?]

All:	35
Single:	23
Double:	12
Rotors:	11
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	6.39
LogP (Chemaxon):	None

Name Annotations

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

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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

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