6-[Hydroxy(diphenyl)methyl]-2-methyl-1lambda~6~,2-thiazinane-1,1-dione
Basic information
- CAS
54531-84-9- Standard SMILES
CN1CCCC(C(O)(c2ccccc2)c2ccccc2)S1(=O)=O- InChIKey
PVFILLLLHRWRTA-UHFFFAOYSA-N- Molecular formula
- C18H21NO3S
- Average molar mass
- 331.4 g/mol
- Monoisotopic mass
- 331.12421471
Names & identifiers
- Preferred name
- 6-[Hydroxy(diphenyl)methyl]-2-methyl-1lambda~6~,2-thiazinane-1,1-dione
- IUPAC
- (2-methyl-1,1-dioxothiazinan-6-yl)-diphenylmethanol
Names & synonyms
54531-84-9NSC277974DTXSID603138406-[Hydroxy(diphenyl)methyl]-2-methyl-1lambda~6~,2-thiazinane-1,1-dioneNSC-2779746-[Hydroxydi(phenyl)methyl]-2-methyl-1lambda~6~,2-thiazinane-1,1-dione
Database identifiers
- CAS
54531-84-9- PubChem CID
- 322071
- DTXSID
DTXSID60313840
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 469
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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