Chemical ID: 6365720

c1cc(ccc1C(=O)Nc2ccc(cc2F)Cl)F
Chemical ID:
6365720
Name [?]:
N-(4-chloro-2-fluoro-phenyl)-4-fluoro-benzamide
SMILES [?]:
c1cc(ccc1C(=O)Nc2ccc(cc2F)Cl)F
InChi [?]:
InChI=1/C13H8ClF2NO/c14-9-3-6-12(11(16)7-9)17-13(18)8-1-4-10(15)5-2-8/h1-7H,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,5,12,2,4,11,14,6,13,3,15,10,7,17,18,16,9,8/E:(1,2)(4,5)/rA:18nCCCCCCCONCCCCCCFClF/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s9;s10;d11;s12;d13;d10s14;s15;s13;s3;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H8ClF2NO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:7.62197
Area:427.036
Solvation:-3.05393
Coulombic:-30.3493
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

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue