Chemical ID: 7317364

c1ccc(c(c1)NS(=O)(=O)c2ccccc2Cl)F
Chemical ID:
7317364
Name [?]:
2-chloro-N-(2-fluorophenyl)-benzenesulfonamide
SMILES [?]:
c1ccc(c(c1)NS(=O)(=O)c2ccccc2Cl)F
InChi [?]:
InChI=1/C12H9ClFNO2S/c13-9-5-1-4-8-12(9)18(16,17)15-11-7-3-2-6-10(11)14/h1-8,15H
InChi Info:
AuxInfo=1/0/N:14,2,1,13,15,3,6,12,16,4,5,11,17,18,7,9,10,8/E:(16,17)/CRV:18.6/rA:18nCCCCCCNSOOCCCCCCClF/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;d8;s8;s11;d12;s13;d14;d11s15;s16;s4;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H9ClFNO2S
All Atoms:27
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:7.52757
Area:410.688
Solvation:-2.73964
Coulombic:-17.7551
Bond Count [?]
All:19
Single:11
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:285.723
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.5
LogP (Chemaxon):3.27

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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