2H-Pyridazino(3,4-e)thiazin-7(6H)-one, 3-methyl-
Basic information
- CAS
82608-24-0- Standard SMILES
Cc1cc2c(nn1)NC(=O)CS2- InChIKey
XOZKAVVDWQPCQB-UHFFFAOYSA-N- Molecular formula
- C7H7N3OS
- Average molar mass
- 181.22 g/mol
- Monoisotopic mass
- 181.03098303
Names & identifiers
- Preferred name
- 2H-Pyridazino(3,4-e)thiazin-7(6H)-one, 3-methyl-
- IUPAC
- 3-methyl-8H-pyridazino[4,3-b][1,4]thiazin-7-one
Names & synonyms
BRN 57394802H-Pyridazino(3,4-e)thiazin-7(6H)-one, 3-methyl-3-Methyl-2H-pyridazino(3,4-e)thiazin-7(6H)-one82608-24-0DTXSID70231925RefChem:268982DTXCID001544163-Methyl-6H-pyridazino[4,3-b][1,4]thiazin-7(8H)-one
Database identifiers
- CAS
82608-24-0- PubChem CID
- 3068014
- DTXSID
DTXSID70231925
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 80.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 199
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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