3-chloro-10H-pyridazino[4,3-b][1,4]benzothiazine
Basic information
- CAS
10344-45-3- Standard SMILES
Clc1cc2c(nn1)Nc1ccccc1S2- InChIKey
GUFFLUIBTAFRHG-UHFFFAOYSA-N- Molecular formula
- C10H6ClN3S
- Average molar mass
- 235.69 g/mol
- Monoisotopic mass
- 234.9970961
Names & identifiers
- Preferred name
- 3-chloro-10H-pyridazino[4,3-b][1,4]benzothiazine
- IUPAC
- 3-chloro-10H-pyridazino[4,3-b][1,4]benzothiazine
Names & synonyms
MLS0007570653-chloro-10H-pyridazino[4,3-b][1,4]benzothiazine10344-45-3NSC301168CHEMBL1529316DTXSID60316230HMS2786C13NSC-301168SMR0004498343-chlor-10H-pyridazino[4,3-b][1,4]benzothiazin
Database identifiers
- CAS
10344-45-3- PubChem CID
- 327173
- DTXSID
DTXSID60316230- ChEMBL
CHEMBL1529316
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 63.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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