Chemical ID: 7304236

CCOc1ccc(cc1OCC)C(C)NC(=O)COc2cc(ccc2C)C
Chemical ID:
7304236
Name [?]:
N-[1-(3,4-diethoxyphenyl)ethyl]-2-(2,5-dimethylphenoxy)-acetamide
SMILES [?]:
CCOc1ccc(cc1OCC)C(C)NC(=O)COc2cc(ccc2C)C
InChi [?]:
InChI=1/C22H29NO4/c1-6-25-19-11-10-18(13-21(19)26-7-2)17(5)23-22(24)14-27-20-12-15(3)8-9-16(20)4/h8-13,17H,6-7,14H2,1-5H3,(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,12,27,26,14,2,11,23,24,6,5,21,8,18,22,25,13,7,4,20,9,16,15,17,3,10,19/rA:27cCCOCCCCCCOCCCCNCOCOCCCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s11;s7;s13;s13;s15;d16;s16;s18;s19;s20;d21;s22;d23;d20s24;s25;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H29NO4
All Atoms:56
Heavy Atoms:27
Chiral Atoms:1
ZAP Information [?]
Total:8.88203
Area:641.855
Solvation:-7.16435
Coulombic:-43.5054
Bond Count [?]
All:28
Single:21
Double:7
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:371.47
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.42
LogP (Chemaxon):4.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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