Chemical ID: 7339380

c1cc(c(cc1F)F)C(=O)Nc2ccc(cc2F)Cl
Chemical ID:
7339380
Name [?]:
N-(4-chloro-2-fluoro-phenyl)-2,4-difluoro-benzamide
SMILES [?]:
c1cc(c(cc1F)F)C(=O)Nc2ccc(cc2F)Cl
InChi [?]:
InChI=1/C13H7ClF3NO/c14-7-1-4-12(11(17)5-7)18-13(19)9-3-2-8(15)6-10(9)16/h1-6H,(H,18,19)
InChi Info:
AuxInfo=1/1/N:14,1,2,13,16,5,15,6,3,4,17,12,9,19,7,8,18,11,10/rA:19nCCCCCCFFCONCCCCCCFCl/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;d9;s9;s11;s12;d13;s14;d15;d12s16;s17;s15;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H7ClF3NO
All Atoms:26
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:6.22982
Area:428.601
Solvation:-4.4852
Coulombic:-31.6276
Bond Count [?]
All:20
Single:13
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:285.649
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.1
LogP (Chemaxon):3.39

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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