Chemical ID: 4203879

c1ccc(c(c1)OCC(=O)Nc2ccc(c(c2)Cl)F)Cl
Chemical ID:
4203879
Name [?]:
N-(3-chloro-4-fluoro-phenyl)-2-(2-chlorophenoxy)-acetamide
SMILES [?]:
c1ccc(c(c1)OCC(=O)Nc2ccc(c(c2)Cl)F)Cl
InChi [?]:
InChI=1/C14H10Cl2FNO2/c15-10-3-1-2-4-13(10)20-8-14(19)18-9-5-6-12(17)11(16)7-9/h1-7H,8H2,(H,18,19)
InChi Info:
AuxInfo=1/1/N:2,1,3,6,13,14,17,8,12,4,16,15,5,9,20,18,19,11,10,7/rA:20nCCCCCCOCCONCCCCCCClFCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s16;s15;s4;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H10Cl2FNO2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.22036
Area:491.723
Solvation:-5.07272
Coulombic:-32.5025
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:314.139
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.08
LogP (Chemaxon):4.05

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Descriptor Annotations

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