General Information of the Compound
| Compound ID |
CP0915980
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
ethyl 4-(3-methoxyphenyl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H20N2O3S
|
||||||||||||||||||
| Molecular Weight |
368.458
|
||||||||||||||||||
| Canonical SMILES |
CCOC(=O)C1=C(c2ccccc2)NC(=S)NC1c1cccc(OC)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H20N2O3S/c1-3-25-19(23)16-17(13-8-5-4-6-9-13)21-20(26)22-18(16)14-10-7-11-15(12-14)24-2/h4-12,18H,3H2,1-2H3,(H2,21,22,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XASXMKQIYGMQJP-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
Protein ID: PT02148, Transient receptor potential cation channel subfamily A member 1
Protein ID: PT02149, Transient receptor potential cation channel subfamily A member 1