General Information of the Compound
| Compound ID |
CP0873267
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(3,4-dimethoxyphenethyl)-2-(2-cyano-N-(2-ethylphenyl)phenylsulfonamido)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H29N3O5S
|
||||||||||||||||||
| Molecular Weight |
507.612
|
||||||||||||||||||
| Canonical SMILES |
CCc1ccccc1N(CC(=O)NCCc1ccc(OC)c(OC)c1)S(=O)(=O)c1ccccc1C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H29N3O5S/c1-4-21-9-5-7-11-23(21)30(36(32,33)26-12-8-6-10-22(26)18-28)19-27(31)29-16-15-20-13-14-24(34-2)25(17-20)35-3/h5-14,17H,4,15-16,19H2,1-3H3,(H,29,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
YXPFYCFFDURBIC-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