General Information of the Compound
| Compound ID |
CP0419704
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-amino-3,5-dichloro-N-[4-(2-chlorophenyl)-1-(4-methylpiperidin-1-yl)-1-oxobutan-2-yl]benzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H26Cl3N3O3S
|
||||||||||||||||||
| Molecular Weight |
518.894
|
||||||||||||||||||
| Canonical SMILES |
CC1CCN(CC1)C(=O)C(CCc1ccccc1Cl)NS(=O)(=O)c1cc(Cl)c(N)c(Cl)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H26Cl3N3O3S/c1-14-8-10-28(11-9-14)22(29)20(7-6-15-4-2-3-5-17(15)23)27-32(30,31)16-12-18(24)21(26)19(25)13-16/h2-5,12-14,20,27H,6-11,26H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
UQZIJONPFBRSEK-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