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Chemical ID: 7056030

Chemical ID:

7056030

Name [?]:

2-[4-(2-ethoxyethoxy)phenoxy]-N-(2-methoxyphenyl)-acetamide

SMILES [?]:

CCOCCOc1ccc(cc1)OCC(=O)Nc2ccccc2OC

InChi [?]:

InChI=1/C19H23NO5/c1-3-23-12-13-24-15-8-10-16(11-9-15)25-14-19(21)20-17-6-4-5-7-18(17)22-2/h4-11H,3,12-14H2,1-2H3,(H,20,21)

InChi Info:

AuxInfo=1/1/N:1,25,2,20,21,19,22,8,12,9,11,4,5,14,7,10,18,23,15,17,16,24,3,6,13/E:(8,9)(10,11)/rA:25nCCOCCOCCCCCCOCCONCCCCCCOC/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;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₉H₂₃NO₅
All Atoms:	48
Heavy Atoms:	25
Chiral Atoms:	0

ZAP Information [?]

Total:	6.83364
Area:	595.605
Solvation:	-8.05648
Coulombic:	-50.3321

Bond Count [?]

All:	26
Single:	19
Double:	7
Rotors:	11
Chiral:	0
Rigid Segments:	8

Chemical Properties

Molecular Weight:	345.39
H-Bond Donors:	1
H-Bond Acceptors:	6
XLogP:	2.74
LogP (Chemaxon):	2.55

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