General Information of the Compound
| Compound ID |
CP0481639
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[[3-[2-(3-bromophenyl)-2-oxoethoxy]phenyl]methyl]-4-methoxy-N-(pyridin-4-ylmethyl)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H25BrN2O4
|
||||||||||||||||||
| Molecular Weight |
545.433
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)C(=O)N(Cc1ccncc1)Cc1cccc(OCC(=O)c2cccc(Br)c2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H25BrN2O4/c1-35-26-10-8-23(9-11-26)29(34)32(18-21-12-14-31-15-13-21)19-22-4-2-7-27(16-22)36-20-28(33)24-5-3-6-25(30)17-24/h2-17H,18-20H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
GRYUVOXTCCCSCZ-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