Basic information
- CAS
6320-57-6- Standard SMILES
CN(C1c2ccccc2Oc2ccccc21)S(=O)(=O)c1ccccc1- InChIKey
OOZRJWUJEUCZNT-UHFFFAOYSA-N- Molecular formula
- C20H17NO3S
- Average molar mass
- 351.4 g/mol
- Monoisotopic mass
- 351.09291458
Names & identifiers
- Preferred name
- n-Methyl-n-(9h-xanthen-9-yl)benzenesulfonamide
- IUPAC
- N-methyl-N-(9H-xanthen-9-yl)benzenesulfonamide
Names & synonyms
6320-57-6n-methyl-n-(9h-xanthen-9-yl)benzenesulfonamideNSC31222DTXSID90979211NSC-31222
Database identifiers
- CAS
6320-57-6- PubChem CID
- 233126
- DTXSID
DTXSID90979211
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 55 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 530
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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