Chemical ID: 4080744

Cc1cccc(c1)S(=O)(=O)Nc2ccc(cc2F)F
Chemical ID:
4080744
Name [?]:
N-(2,4-difluorophenyl)-3-methyl-benzenesulfonamide
SMILES [?]:
Cc1cccc(c1)S(=O)(=O)Nc2ccc(cc2F)F
InChi [?]:
InChI=1/C13H11F2NO2S/c1-9-3-2-4-11(7-9)19(17,18)16-13-6-5-10(14)8-12(13)15/h2-8,16H,1H3
InChi Info:
AuxInfo=1/0/N:1,4,3,5,14,13,7,16,2,15,6,17,12,19,18,11,9,10,8/E:(17,18)/CRV:19.6/rA:19nCCCCCCCSOONCCCCCCFF/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;d8;s8;s11;s12;d13;s14;d15;d12s16;s17;s15;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H11F2NO2S
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.36966
Area:421.268
Solvation:-3.16203
Coulombic:-20.0772
Bond Count [?]
All:20
Single:12
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:283.295
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.47
LogP (Chemaxon):3.35

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