Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
3-(3-Methyl-2-oxo-1,3-benzothiazol-6-yl)-2-oxo-1,3-oxazolidine-5-carboxamide (HCID 21877977)|Huagongshe
Home
/
Compound
3-(3-Methyl-2-oxo-1,3-benzothiazol-6-yl)-2-oxo-1,3-oxazolidine-5-carboxamide
HCID
21877977
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
Cn1c(=O)sc2cc(N3CC(C(N)=O)OC3=O)ccc21
InChIKey
WAGKFNIYFRFVPU-UHFFFAOYSA-N
Molecular formula
C12H11N3O4S
Average molar mass
293.3 g/mol
Names & identifiers
Preferred name
3-(3-Methyl-2-oxo-1,3-benzothiazol-6-yl)-2-oxo-1,3-oxazolidine-5-carboxamide
IUPAC
3-(3-methyl-2-oxo-1,3-benzothiazol-6-yl)-2-oxo-1,3-oxazolidine-5-carboxamide
Database identifiers
PubChem CID
21877977
Properties
Computed structural properties
XLogP
0.4
Topological polar surface area
118 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
20
Formal charge
0
Complexity
472
Show all 8
Show all 8 / 8
Related reactions
2 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
835981
As product
Test data from https://doi.org/10.1039/C8SC04228D
HRID
2133835
As product
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Compound notes
Loading…