General Information of the Compound
| Compound ID |
CP0538863
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(6-methoxypyridin-3-yl)-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]pyridine-2-sulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H18N4O3S2
|
||||||||||||||||||
| Molecular Weight |
438.534
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cn1)N(Cc1nc(cs1)-c1ccccc1)S(=O)(=O)c1ccccn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H18N4O3S2/c1-28-19-11-10-17(13-23-19)25(30(26,27)21-9-5-6-12-22-21)14-20-24-18(15-29-20)16-7-3-2-4-8-16/h2-13,15H,14H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
OVIDPZAVLGFRQA-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