2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-
Basic information
- CAS
7059-31-6- Standard SMILES
CCC1(c2ccccc2)CSC(=O)NC1=O- InChIKey
DUCJTYVEBJXBMM-UHFFFAOYSA-N- Molecular formula
- C12H13NO2S
- Average molar mass
- 235.3 g/mol
- Monoisotopic mass
- 235.06669983
Names & identifiers
- Preferred name
- 2H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-
- IUPAC
- 5-ethyl-5-phenyl-1,3-thiazinane-2,4-dione
Names & synonyms
7059-31-62H-1,3-Thiazine-2,4(3H)-dione, dihydro-5-ethyl-5-phenyl-RefChem:1065032L 3882BRN 0984838Dihydro-5-ethyl-5-phenyl-2H-1,3-thiazine-2,4(3H)-dione5-Etildiidro-5-fenil-1,3-tiazin-2,4-dione [Italian]5-Etildiidro-5-fenil-1,3-tiazin-2,4-dioneDTXSID409908105-Ethyl-4-hydroxy-5-phenyl-5,6-dihydro-2H-1,3-thiazin-2-one
Database identifiers
- CAS
7059-31-6- PubChem CID
- 201891
- DTXSID
DTXSID40990810
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 71.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 299
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Compound notes
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