General Information of the Compound
| Compound ID |
CP0574400
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
8-[[N-(2-cyanoethyl)-3,5-difluoroanilino]methyl]-N,N-dimethyl-2-morpholin-4-yl-4-oxochromene-6-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H26F2N4O4
|
||||||||||||||||||
| Molecular Weight |
496.514
|
||||||||||||||||||
| Canonical SMILES |
CN(C)C(=O)c1cc(CN(CCC#N)c2cc(F)cc(F)c2)c2oc(cc(=O)c2c1)N1CCOCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H26F2N4O4/c1-30(2)26(34)17-10-18(16-32(5-3-4-29)21-13-19(27)12-20(28)14-21)25-22(11-17)23(33)15-24(36-25)31-6-8-35-9-7-31/h10-15H,3,5-9,16H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
JJYQOSCSPRWEDA-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