Chemical ID: 4028859

c1cc2cccnc2c(c1)NS(=O)(=O)c3cccs3
Chemical ID:
4028859
Name [?]:
N-(8-quinolyl)thiophene-2-sulfonamide
SMILES [?]:
c1cc2cccnc2c(c1)NS(=O)(=O)c3cccs3
InChi [?]:
InChI=1/C13H10N2O2S2/c16-19(17,12-7-3-9-18-12)15-11-6-1-4-10-5-2-8-14-13(10)11/h1-9,15H
InChi Info:
AuxInfo=1/0/N:1,5,17,2,4,10,16,6,18,3,9,15,8,7,11,13,14,19,12/E:(16,17)/CRV:19.6/rA:19nCCCCCCNCCCNSOOCCCCS/rB:s1;d2;s3;d4;s5;d6;s3s7;d8;d1s9;s9;s11;d12;d12;s12;d15;s16;d17;s15s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H10N2O2S2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.71468
Area:437.302
Solvation:-2.21786
Coulombic:-19.2949
Bond Count [?]
All:21
Single:12
Double:9
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:290.363
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.88
LogP (Chemaxon):2.29

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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