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Chemical ID: 7056066

Chemical ID:

7056066

Name [?]:

2-[4-(2-ethoxyethoxy)phenoxy]-N-(2-methoxy-5-methyl-phenyl)-acetamide

SMILES [?]:

CCOCCOc1ccc(cc1)OCC(=O)Nc2cc(ccc2OC)C

InChi [?]:

InChI=1/C20H25NO5/c1-4-24-11-12-25-16-6-8-17(9-7-16)26-14-20(22)21-18-13-15(2)5-10-19(18)23-3/h5-10,13H,4,11-12,14H2,1-3H3,(H,21,22)

InChi Info:

AuxInfo=1/1/N:1,26,25,2,21,8,12,9,11,22,4,5,19,14,20,7,10,18,23,15,17,16,24,3,6,13/E:(6,7)(8,9)/rA:26nCCOCCOCCCCCCOCCONCCCCCCOCC/rB:s1;s2;s3;s4;s5;s6;s7;d8;s9;d10;d7s11;s10;s13;s14;d15;s15;s17;s18;d19;s20;d21;d18s22;s23;s24;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₀H₂₅NO₅
All Atoms:	51
Heavy Atoms:	26
Chiral Atoms:	0

ZAP Information [?]

Total:	7.43302
Area:	619.028
Solvation:	-8.04268
Coulombic:	-50.119

Bond Count [?]

All:	27
Single:	20
Double:	7
Rotors:	11
Chiral:	0
Rigid Segments:	8

Chemical Properties

Molecular Weight:	359.416
H-Bond Donors:	1
H-Bond Acceptors:	6
XLogP:	3.17
LogP (Chemaxon):	3.02

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value