General Information of the Compound
| Compound ID |
CP0497178
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-(4-chlorophenyl)-3-[2-methyl-1-(4-methylphenyl)benzimidazol-5-yl]thieno[3,2-d]pyrimidin-4-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H19ClN4OS
|
||||||||||||||||||
| Molecular Weight |
482.996
|
||||||||||||||||||
| Canonical SMILES |
Cc1nc2cc(ccc2n1-c1ccc(C)cc1)-n1cnc2cc(sc2c1=O)-c1ccc(Cl)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H19ClN4OS/c1-16-3-9-20(10-4-16)32-17(2)30-22-13-21(11-12-24(22)32)31-15-29-23-14-25(34-26(23)27(31)33)18-5-7-19(28)8-6-18/h3-15H,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
YZZHYSIHUSTHFU-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