Basic information
- CAS
87690-09-3- Standard SMILES
Cc1ccc(C)c(C(C)N(CC2CO2)S(=O)(=O)c2ccccc2)c1- InChIKey
JJICTPDIJRMIKN-UHFFFAOYSA-N- Molecular formula
- C19H23NO3S
- Average molar mass
- 345.5 g/mol
- Monoisotopic mass
- 345.13986477
Names & identifiers
- Preferred name
- Benzenesulfonamide, N-(1-(2,5-dimethylphenyl)ethyl)-N-(2-oxiranylmethyl)-
- IUPAC
- N-[1-(2,5-dimethylphenyl)ethyl]-N-(oxiran-2-ylmethyl)benzenesulfonamide
Names & synonyms
87690-09-3DTXSID701007747Benzenesulfonamide, N-(1-(2,5-dimethylphenyl)ethyl)-N-(2-oxiranylmethyl)-N-[1-(2,5-Dimethylphenyl)ethyl]-N-[(oxiran-2-yl)methyl]benzenesulfonamide
Database identifiers
- CAS
87690-09-3- PubChem CID
- 190085
- DTXSID
DTXSID701007747
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 58.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 509
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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