General Information of the Compound
| Compound ID |
CP0430993
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N,4-dimethyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H15N3OS
|
||||||||||||||||||
| Molecular Weight |
309.394
|
||||||||||||||||||
| Canonical SMILES |
CN(C(=O)c1ccc(C)cc1)c1nc(cs1)-c1ccncc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H15N3OS/c1-12-3-5-14(6-4-12)16(21)20(2)17-19-15(11-22-17)13-7-9-18-10-8-13/h3-11H,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
CPYNENNNFDPGKD-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