General Information of the Compound
| Compound ID |
CP0897975
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| Compound Name |
4-(3-chloro-4-cyanophenoxy)-3-cyano-N-(thiazol-2-yl)benzenesulfonamide
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| Synonyms |
PMID27414413-Compound-Figure3bottomright
Sulfonamide derivative 11
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| Structure |
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| Formula |
C17H9ClN4O3S2
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| Molecular Weight |
416.871
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| Canonical SMILES |
N#Cc1ccc(Oc2ccc(S(=O)(=O)Nc3nccs3)cc2C#N)cc1Cl
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| InChI |
InChI=1S/C17H9ClN4O3S2/c18-15-8-13(2-1-11(15)9-19)25-16-4-3-14(7-12(16)10-20)27(23,24)22-17-21-5-6-26-17/h1-8H,(H,21,22)
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| InChIKey |
JONVMVCPXBMHHN-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound