Basic information
- Standard SMILES
CN(C)c1ccc2c(c1)C(=O)N(S(C)(=O)=O)C2=O- InChIKey
RUGYEANCZKFGPG-UHFFFAOYSA-N- Molecular formula
- C11H12N2O4S
- Average molar mass
- 268.29 g/mol
- Monoisotopic mass
- 268.05177804
Names & identifiers
- Preferred name
- Phthalimido methylsulfone,5-(N,N-dimethylamino)-
- IUPAC
- 5-(dimethylamino)-2-methylsulfonylisoindole-1,3-dione
Names & synonyms
DTXSID70876355Phthalimido methylsulfone,5-(N,N-dimethylamino)-5-(Dimethylamino)-2-(methanesulfonyl)-1H-isoindole-1,3(2H)-dione
Database identifiers
- PubChem CID
- 85580445
- DTXSID
DTXSID70876355
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 480
Experimental & physicochemical properties
LogP1.65
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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