General Information of the Compound
| Compound ID |
CP0130523
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(2-methylsulfonylpyrimidin-4-yl)-6-(3-phenylmethoxyphenyl)imidazo[2,1-b][1,3]thiazole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H18N4O3S2
|
||||||||||||||||||
| Molecular Weight |
462.556
|
||||||||||||||||||
| Canonical SMILES |
CS(=O)(=O)c1nccc(n1)-c1c(nc2sccn12)-c1cccc(OCc2ccccc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H18N4O3S2/c1-32(28,29)22-24-11-10-19(25-22)21-20(26-23-27(21)12-13-31-23)17-8-5-9-18(14-17)30-15-16-6-3-2-4-7-16/h2-14H,15H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
DQOWVAQFOQHAFL-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 | |||||||||||||||||||