General Information of the Compound
| Compound ID |
CP0185518
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6,7-Dimethoxy-2-methyl-1,1-dioxo-1,2,3,4-tetrahydro-1lambda*6*-benzo[e][1,2]thiazine-3-carboxylic acid (1-benzyl-2-oxo-ethyl)-amide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H24N2O6S
|
||||||||||||||||||
| Molecular Weight |
432.498
|
||||||||||||||||||
| Canonical SMILES |
COc1cc2CC(N(C)S(=O)(=O)c2cc1OC)C(=O)N[C@@H](Cc1ccccc1)C=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H24N2O6S/c1-23-17(21(25)22-16(13-24)9-14-7-5-4-6-8-14)10-15-11-18(28-2)19(29-3)12-20(15)30(23,26)27/h4-8,11-13,16-17H,9-10H2,1-3H3,(H,22,25)/t16-,17?/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
RVMZUHOZKYCBJC-BHWOMJMDSA-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