ST026298
Basic information
- CAS
52039-28-8- Standard SMILES
Nc1nc(-c2ccccc2)cc(=S)s1- InChIKey
PMCYYVHDPYDPOO-UHFFFAOYSA-N- Molecular formula
- C10H8N2S2
- Average molar mass
- 220.3 g/mol
- Monoisotopic mass
- 220.01289061
Names & identifiers
- Preferred name
- ST026298
- IUPAC
- 2-amino-4-phenyl-1,3-thiazine-6-thione
Names & synonyms
52039-28-8ST026298DTXSID60352052RefChem:381323DTXCID903031182-amino-4-phenyl-1,3-thiazine-6-thione2-Amino-4-phenyl-6H-1,3-thiazine-6-thione6H-1,3-Thiazine-6-thione, 2-amino-4-phenyl-CCG-2645TimTec1_002047HMS1539N01AKOS024279302
Show more names
AB00086887-01BRD-K30356489-001-01-3
Database identifiers
- CAS
52039-28-8- PubChem CID
- 717441
- DTXSID
DTXSID60352052
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 95.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 301
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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