General Information of the Compound
| Compound ID |
CP0375962
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-[1-(Quinoline-8-sulfonyl)-piperidin-4-yl]-1,4-dihydro-benzo[d][1,3]oxazin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H21N3O4S
|
||||||||||||||||||
| Molecular Weight |
423.494
|
||||||||||||||||||
| Canonical SMILES |
O=C1OCc2ccccc2N1C1CCN(CC1)S(=O)(=O)c1cccc2cccnc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H21N3O4S/c26-22-25(19-8-2-1-5-17(19)15-29-22)18-10-13-24(14-11-18)30(27,28)20-9-3-6-16-7-4-12-23-21(16)20/h1-9,12,18H,10-11,13-15H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
RJGHKJBJOGXPNK-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