Chemical ID: 4396983

CCCCOc1ccc(cc1)C(=O)Nc2ccc(cc2Cl)Cl
Chemical ID:
4396983
Name [?]:
4-butoxy-N-(2,4-dichlorophenyl)-benzamide
SMILES [?]:
CCCCOc1ccc(cc1)C(=O)Nc2ccc(cc2Cl)Cl
InChi [?]:
InChI=1/C17H17Cl2NO2/c1-2-3-10-22-14-7-4-12(5-8-14)17(21)20-16-9-6-13(18)11-15(16)19/h4-9,11H,2-3,10H2,1H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,2,3,8,10,17,7,11,16,4,19,9,18,6,20,15,12,22,21,14,13,5/E:(4,5)(7,8)/rA:22nCCCCOCCCCCCCONCCCCCCClCl/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s9;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;s18;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H17Cl2NO2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:11.3037
Area:558.204
Solvation:-2.6514
Coulombic:-31.6037
Bond Count [?]
All:23
Single:16
Double:7
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:338.228
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.5
LogP (Chemaxon):4.44

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Descriptor Annotations

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