General Information of the Compound
| Compound ID |
CP0464407
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(3,4-dimethoxyphenyl)-2-[N-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)anilino]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H23F3N2O5S
|
||||||||||||||||||
| Molecular Weight |
508.518
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(NC(=O)CN(c2cccc(c2)C(F)(F)F)S(=O)(=O)c2ccc(C)cc2)cc1OC
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H23F3N2O5S/c1-16-7-10-20(11-8-16)35(31,32)29(19-6-4-5-17(13-19)24(25,26)27)15-23(30)28-18-9-12-21(33-2)22(14-18)34-3/h4-14H,15H2,1-3H3,(H,28,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
WICHGKVYWQSUAI-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