Chemical ID: 6360936

Cc1cc(ccc1OCCCC(=O)Nc2cccc(c2C)Cl)Cl
Chemical ID:
6360936
Name [?]:
4-(4-chloro-2-methyl-phenoxy)-N-(3-chloro-2-methyl-phenyl)-butanamide
SMILES [?]:
Cc1cc(ccc1OCCCC(=O)Nc2cccc(c2C)Cl)Cl
InChi [?]:
InChI=1/C18H19Cl2NO2/c1-12-11-14(19)8-9-17(12)23-10-4-7-18(22)21-16-6-3-5-15(20)13(16)2/h3,5-6,8-9,11H,4,7,10H2,1-2H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,21,17,10,18,16,11,5,6,9,3,2,20,4,19,15,7,12,23,22,14,13,8/rA:23nCCCCCCCOCCCCONCCCCCCCClCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;s19;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19Cl2NO2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.9977
Area:579.411
Solvation:-3.48758
Coulombic:-28.7851
Bond Count [?]
All:24
Single:17
Double:7
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:352.254
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.89
LogP (Chemaxon):4.63

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Descriptor Annotations

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