Chemical ID: 6836593

c1ccc(c(c1)[N-]S(=O)(=O)c2cccc(c2)Cl)F
Chemical ID:
6836593
Name [?]:
(3-chlorophenyl)sulfonyl-(2-fluorophenyl)-azanide
SMILES [?]:
c1ccc(c(c1)[N-]S(=O)(=O)c2cccc(c2)Cl)F
InChi [?]:
InChI=1/C12H8ClFNO2S/c13-9-4-3-5-10(8-9)18(16,17)15-12-7-2-1-6-11(12)14/h1-8H/q-1
InChi Info:
AuxInfo=1/0/N:2,1,13,14,12,3,6,16,15,11,4,5,17,18,7,9,10,8/E:(16,17)/CRV:15-1,18.6/rA:18nCCCCCCN-SOOCCCCCCClF/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;d8;s8;s11;d12;s13;d14;d11s15;s15;s4;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H8ClFNO2S-
All Atoms:26
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:-23.429
Area:439.791
Solvation:-34.4238
Coulombic:18.6437
Bond Count [?]
All:19
Single:11
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:284.715
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.34
LogP (Chemaxon):3.27

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