General Information of the Compound
| Compound ID |
CP0511038
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-[2-(dimethylamino)ethylamino]-2-(furan-2-yl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H21F6N3O2
|
||||||||||||||||||
| Molecular Weight |
437.384
|
||||||||||||||||||
| Canonical SMILES |
CN(C)CCNC(C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1ccco1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H21F6N3O2/c1-28(2)6-5-26-16(15-4-3-7-30-15)17(29)27-11-12-8-13(18(20,21)22)10-14(9-12)19(23,24)25/h3-4,7-10,16,26H,5-6,11H2,1-2H3,(H,27,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HPLHOKOTNJQVJU-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