Chemical ID: 5737815

c1cc(c(cc1F)F)C(=O)Nc2cc(cc(c2)Cl)Cl
Chemical ID:
5737815
Name [?]:
N-(3,5-dichlorophenyl)-2,4-difluoro-benzamide
SMILES [?]:
c1cc(c(cc1F)F)C(=O)Nc2cc(cc(c2)Cl)Cl
InChi [?]:
InChI=1/C13H7Cl2F2NO/c14-7-3-8(15)5-10(4-7)18-13(19)11-2-1-9(16)6-12(11)17/h1-6H,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,2,15,13,17,5,14,16,6,12,3,4,9,19,18,7,8,11,10/E:(4,5)(7,8)(14,15)/rA:19nCCCCCCFFCONCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;d9;s9;s11;s12;d13;s14;d15;d12s16;s16;s14;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H7Cl2F2NO
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.24047
Area:457.572
Solvation:-4.19883
Coulombic:-27.5894
Bond Count [?]
All:20
Single:13
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:302.103
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.56
LogP (Chemaxon):4.42

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