Chemical ID: 5366584

CCCCCCOc1ccc(cc1OC)C(NC(=O)C)NC(=O)C
Chemical ID:
5366584
Name [?]:
N-[acetamido-(4-hexoxy-3-methoxy-phenyl)-methyl]acetamide
SMILES [?]:
CCCCCCOc1ccc(cc1OC)C(NC(=O)C)NC(=O)C
InChi [?]:
InChI=1/C18H28N2O4/c1-5-6-7-8-11-24-16-10-9-15(12-17(16)23-4)18(19-13(2)21)20-14(3)22/h9-10,12,18H,5-8,11H2,1-4H3,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,20,24,15,2,3,4,5,10,9,6,12,18,22,11,8,13,16,17,21,19,23,14,7/E:(2,3)(13,14)(19,20)(21,22)/gE:(1,2)/rA:24nCCCCCCOCCCCCCOCCNCOCNCOC/rB:s1;s2;s3;s4;s5;s6;s7;s8;d9;s10;d11;d8s12;s13;s14;s11;s16;s17;d18;s18;s16;s21;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H28N2O4
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:7.93478
Area:596.889
Solvation:-6.98745
Coulombic:-53.6306
Bond Count [?]
All:24
Single:19
Double:5
Rotors:12
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:336.426
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.21
LogP (Chemaxon):1.86

Name Annotations

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Descriptor Annotations

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