Chemical ID: 6462582

Cc1ccccc1S(=O)(=O)Nc2ccc(cc2)I
Chemical ID:
6462582
Name [?]:
N-(4-iodophenyl)-2-methyl-benzenesulfonamide
SMILES [?]:
Cc1ccccc1S(=O)(=O)Nc2ccc(cc2)I
InChi [?]:
InChI=1/C13H12INO2S/c1-10-4-2-3-5-13(10)18(16,17)15-12-8-6-11(14)7-9-12/h2-9,15H,1H3
InChi Info:
AuxInfo=1/0/N:1,4,5,3,6,14,16,13,17,2,15,12,7,18,11,9,10,8/E:(6,7)(8,9)(16,17)/CRV:18.6/rA:18nCCCCCCCSOONCCCCCCI/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;d8;s8;s11;s12;d13;s14;d15;d12s16;s15;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H12INO2S
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.60183
Area:448.103
Solvation:-1.60074
Coulombic:-14.2485
Bond Count [?]
All:19
Single:11
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:373.21
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.01
LogP (Chemaxon):4.07

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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