General Information of the Compound
| Compound ID |
CP0869626
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(2-Benzoyl-phenyl)-2-[4-(8-methyl-2-oxo-4H-benzo[d][1,3]oxazin-1-yl)-piperidin-1-yl]-acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H30ClN3O4
|
||||||||||||||||||
| Molecular Weight |
520.029
|
||||||||||||||||||
| Canonical SMILES |
Cc1cccc2c1N(C1CCN(CC(=O)Nc3ccccc3C(=O)c3ccccc3)CC1)C(=O)OC2.Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H29N3O4.ClH/c1-20-8-7-11-22-19-36-29(35)32(27(20)22)23-14-16-31(17-15-23)18-26(33)30-25-13-6-5-12-24(25)28(34)21-9-3-2-4-10-21;/h2-13,23H,14-19H2,1H3,(H,30,33);1H
Show/Hide
|
||||||||||||||||||
| InChIKey |
IXJMQJPSBHBEGP-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