Chemical ID: 5623423

CCCCc1ccc(cc1)NC(=O)COc2ccc(cc2Cl)Cl
Chemical ID:
5623423
Name [?]:
N-(4-butylphenyl)-2-(2,4-dichlorophenoxy)-acetamide
SMILES [?]:
CCCCc1ccc(cc1)NC(=O)COc2ccc(cc2Cl)Cl
InChi [?]:
InChI=1/C18H19Cl2NO2/c1-2-3-4-13-5-8-15(9-6-13)21-18(22)12-23-17-10-7-14(19)11-16(17)20/h5-11H,2-4,12H2,1H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,2,3,4,6,10,18,7,9,17,20,14,5,19,8,21,16,12,23,22,11,13,15/E:(5,6)(8,9)/rA:23nCCCCCCCCCCNCOCOCCCCCCClCl/rB:s1;s2;s3;s4;s5;d6;s7;d8;d5s9;s8;s11;d12;s12;s14;s15;s16;d17;s18;d19;d16s20;s21;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19Cl2NO2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.3977
Area:587.54
Solvation:-4.29076
Coulombic:-29.9141
Bond Count [?]
All:24
Single:17
Double:7
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:352.254
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.96
LogP (Chemaxon):5.57

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Descriptor Annotations

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