Basic information
- Standard SMILES
CC(C)(C)OC(=O)CCCCCOc1ccc2sc(-c3ccccn3)nc(=O)c2c1- InChIKey
RZSYEMCRMLPPCV-UHFFFAOYSA-N- Molecular formula
- C23H26N2O4S
- Average molar mass
- 426.5 g/mol
- Monoisotopic mass
- 426.16132849
Names & identifiers
- Preferred name
- tert-Butyl 6-[[4-oxo-2-(2-pyridyl)-4H-1,3-benzothiazin-6-yl]oxy]hexanoate
- IUPAC
- tert-butyl 6-[(4-oxo-2-pyridin-2-yl-1,3-benzothiazin-6-yl)oxy]hexanoate
Names & synonyms
SCHEMBL2964081RZSYEMCRMLPPCV-UHFFFAOYSA-Ntert-Butyl 6-[[4-oxo-2-(2-pyridyl)-4H-1,3-benzothiazin-6-yl]oxy]hexano atetert-Butyl 6-[[4-oxo-2-(2-pyridyl)-4H-1,3-benzothiazin-6-yl]oxy]hexanoate
Database identifiers
- PubChem CID
- 68459181
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 631
Related reactions
6 records
Compound notes
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