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Chemical ID: 5101319

c1ccc(cc1)c2ccc(cc2)OCC(=O)Nc3cccc4c3cccc4

Chemical ID:

5101319

Name [?]:

N-(1-naphthyl)-2-(4-phenylphenoxy)-acetamide

SMILES [?]:

c1ccc(cc1)c2ccc(cc2)OCC(=O)Nc3cccc4c3cccc4

InChi [?]:

InChI=1/C24H19NO2/c26-24(25-23-12-6-10-20-9-4-5-11-22(20)23)17-27-21-15-13-19(14-16-21)18-7-2-1-3-8-18/h1-16H,17H2,(H,25,26)

InChi Info:

AuxInfo=1/1/N:1,2,6,26,25,20,3,5,27,21,24,19,8,12,9,11,14,4,7,22,10,23,18,15,17,16,13/E:(2,3)(7,8)(13,14)(15,16)/rA:27nCCCCCCCCCCCCOCCONCCCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;d7s11;s10;s13;s14;d15;s15;s17;s18;d19;s20;d21;d18s22;s23;d24;s25;s22d26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₄H₁₉NO₂
All Atoms:	27
Heavy Atoms:	27
Chiral Atoms:	0

ZAP Information [?]

Total:	10.0789
Area:	584.034
Solvation:	-4.52191
Coulombic:	-31.7615

Bond Count [?]

All:	30
Single:	18
Double:	12
Rotors:	6
Chiral:	0
Rigid Segments:	5

Chemical Properties

Molecular Weight:	353.413
H-Bond Donors:	1
H-Bond Acceptors:	3
XLogP:	5.88
LogP (Chemaxon):	5.56

Name Annotations

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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