General Information of the Compound
| Compound ID |
CP0463893
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[3-[(4-chlorophenyl)sulfonylamino]phenoxy]-3-cyano-N,N,6-trimethylpyridine-4-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H19ClN4O4S
|
||||||||||||||||||
| Molecular Weight |
470.938
|
||||||||||||||||||
| Canonical SMILES |
CN(C)C(=O)c1cc(C)nc(Oc2cccc(NS(=O)(=O)c3ccc(Cl)cc3)c2)c1C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H19ClN4O4S/c1-14-11-19(22(28)27(2)3)20(13-24)21(25-14)31-17-6-4-5-16(12-17)26-32(29,30)18-9-7-15(23)8-10-18/h4-12,26H,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
RIKHVBSKPOGBAX-UHFFFAOYSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound