General Information of the Compound
| Compound ID |
CP0572372
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(5-chloro-2-propoxyphenyl)methyl]-N-[2-(4-morpholin-4-ylsulfonylphenyl)ethyl]-2-thiophen-3-ylacetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H33ClN2O5S2
|
||||||||||||||||||
| Molecular Weight |
577.168
|
||||||||||||||||||
| Canonical SMILES |
CCCOc1ccc(Cl)cc1CN(CCc1ccc(cc1)S(=O)(=O)N1CCOCC1)C(=O)Cc1ccsc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H33ClN2O5S2/c1-2-14-36-27-8-5-25(29)19-24(27)20-30(28(32)18-23-10-17-37-21-23)11-9-22-3-6-26(7-4-22)38(33,34)31-12-15-35-16-13-31/h3-8,10,17,19,21H,2,9,11-16,18,20H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
CVYOPZKUUYJUHO-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 | |||||||||||||||||||
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