General Information of the Compound
| Compound ID |
CP0852623
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(2-hydroxybenzamido)-5,7-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H18N2O4S
|
||||||||||||||||||
| Molecular Weight |
346.408
|
||||||||||||||||||
| Canonical SMILES |
CC1Cc2c(sc(NC(=O)c3ccccc3O)c2C(N)=O)C(C)O1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H18N2O4S/c1-8-7-11-13(15(18)21)17(24-14(11)9(2)23-8)19-16(22)10-5-3-4-6-12(10)20/h3-6,8-9,20H,7H2,1-2H3,(H2,18,21)(H,19,22)
Show/Hide
|
||||||||||||||||||
| InChIKey |
PBKNYWOKAUKJJG-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