Chemical ID: 7467366

Cc1cc(cc(c1Cl)C)OCC(=O)Nc2cccc(c2Cl)Cl
Chemical ID:
7467366
Name [?]:
2-(4-chloro-3,5-dimethyl-phenoxy)-N-(2,3-dichlorophenyl)-acetamide
SMILES [?]:
Cc1cc(cc(c1Cl)C)OCC(=O)Nc2cccc(c2Cl)Cl
InChi [?]:
InChI=1/C16H14Cl3NO2/c1-9-6-11(7-10(2)15(9)18)22-8-14(21)20-13-5-3-4-12(17)16(13)19/h3-7H,8H2,1-2H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,9,17,18,16,3,5,11,2,6,4,19,15,12,7,20,22,8,21,14,13,10/E:(1,2)(6,7)(9,10)/rA:22nCCCCCCCClCOCCONCCCCCCClCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s4;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14Cl3NO2
All Atoms:36
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.1265
Area:548.928
Solvation:-3.59667
Coulombic:-30.1007
Bond Count [?]
All:23
Single:16
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:358.646
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.99
LogP (Chemaxon):4.71

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue