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Chemical ID: 6199156
Chemical ID:
6199156
Name [?]:
N-(2-pyridyl)thiophene-2-sulfonamide
SMILES [?]:
c1ccnc(c1)NS(=O)(=O)c2cccs2
InChi [?]:
InChI=1/C9H8N2O2S2/c12-15(13,9-5-3-7-14-9)11-8-4-1-2-6-10-8/h1-7H,(H,10,11)
InChi Info:
AuxInfo=1/1/N:1,2,13,6,12,3,14,5,11,4,7,9,10,15,8/E:(12,13)/CRV:15.6/rA:15nCCCNCCNSOOCCCCS/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;d8;s8;d11;s12;d13;s11s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C9H8N2O2S2 |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.67105 |
Area: | 378.835 |
Solvation: | -2.79982 |
Coulombic: | -17.1579 |
Bond Count [?]
All: | 16 |
Single: | 9 |
Double: | 7 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 240.304 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 1.25 |
LogP (Chemaxon): | 1.59 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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