Chemical ID: 4724659

c1ccc(c(c1)C(=O)Nc2ccc(cc2Cl)F)F
Chemical ID:
4724659
Name [?]:
N-(2-chloro-4-fluoro-phenyl)-2-fluoro-benzamide
SMILES [?]:
c1ccc(c(c1)C(=O)Nc2ccc(cc2Cl)F)F
InChi [?]:
InChI=1/C13H8ClF2NO/c14-10-7-8(15)5-6-12(10)17-13(18)9-3-1-2-4-11(9)16/h1-7H,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,12,11,14,13,5,15,4,10,7,16,17,18,9,8/rA:18nCCCCCCCONCCCCCCClFF/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;s10;d11;s12;d13;d10s14;s15;s13;s4;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H8ClF2NO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:6.71748
Area:415.881
Solvation:-3.67955
Coulombic:-29.2072
Bond Count [?]
All:19
Single:12
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:267.658
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.94
LogP (Chemaxon):3.25

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Descriptor Annotations

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