Chemical ID: 7509879

CN(c1cccc(c1)NC(=O)c2ccc(c(c2)S(=O)(=O)Nc3ccccc3)Cl)S(=O)(=O)C
Chemical ID:
7509879
Name [?]:
4-chloro-N-[3-(methyl-methylsulfonyl-amino)phenyl]-3-(phenylsulfamoyl)benzamide
SMILES [?]:
CN(c1cccc(c1)NC(=O)c2ccc(c(c2)S(=O)(=O)Nc3ccccc3)Cl)S(=O)(=O)C
InChi [?]:
InChI=1/C21H20ClN3O5S2/c1-25(31(2,27)28)18-10-6-9-17(14-18)23-21(26)15-11-12-19(22)20(13-15)32(29,30)24-16-7-4-3-5-8-16/h3-14,24H,1-2H3,(H,23,26)
InChi Info:
AuxInfo=1/1/N:1,32,25,24,26,5,23,27,6,4,13,14,17,8,12,22,7,3,15,16,10,28,9,21,2,11,30,31,19,20,29,18/E:(4,5)(7,8)(27,28)(29,30)/CRV:31.6,32.6/rA:32cCNCCCCCCNCOCCCCCCSOONCCCCCCClSOOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;d10;s10;s12;d13;s14;d15;d12s16;s16;d18;d18;s18;s21;s22;d23;s24;d25;d22s26;s15;s2;d29;d29;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H20ClN3O5S2
All Atoms:52
Heavy Atoms:32
Chiral Atoms:None
ZAP Information [?]
Total:11.5151
Area:674.516
Solvation:-5.34783
Coulombic:-37.8643
Bond Count [?]
All:34
Single:20
Double:14
Rotors:8
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.11
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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