General Information of the Compound
| Compound ID |
CP0875175
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-Methoxybenzyl 2-oxo-4-phenyl-6-(thiophen-2-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H20N2O4S
|
||||||||||||||||||
| Molecular Weight |
420.49
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(COC(=O)C2=C(c3cccs3)NC(=O)NC2c2ccccc2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H20N2O4S/c1-28-17-11-9-15(10-12-17)14-29-22(26)19-20(16-6-3-2-4-7-16)24-23(27)25-21(19)18-8-5-13-30-18/h2-13,20H,14H2,1H3,(H2,24,25,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
BALKLJYKTFYRRF-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