General Information of the Compound
| Compound ID |
CP0563989
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2,4-difluoro-N-[3-[5-(2-methyl-1-oxo-3H-isoindol-5-yl)thiophen-2-yl]phenyl]benzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H18F2N2O3S2
|
||||||||||||||||||
| Molecular Weight |
496.56
|
||||||||||||||||||
| Canonical SMILES |
CN1Cc2cc(ccc2C1=O)-c1ccc(s1)-c1cccc(NS(=O)(=O)c2ccc(F)cc2F)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H18F2N2O3S2/c1-29-14-17-11-16(5-7-20(17)25(29)30)23-9-8-22(33-23)15-3-2-4-19(12-15)28-34(31,32)24-10-6-18(26)13-21(24)27/h2-13,28H,14H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
PZLMWPAKWJFBFJ-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