N,3,4-Trimethyl-N-(9H-xanthen-9-yl)benzene-1-sulfonamide
Basic information
- CAS
6320-59-8- Standard SMILES
Cc1ccc(S(=O)(=O)N(C)C2c3ccccc3Oc3ccccc32)cc1C- InChIKey
SZYYBRVMOHQASZ-UHFFFAOYSA-N- Molecular formula
- C22H21NO3S
- Average molar mass
- 379.5 g/mol
- Monoisotopic mass
- 379.12421471
Names & identifiers
- Preferred name
- N,3,4-Trimethyl-N-(9H-xanthen-9-yl)benzene-1-sulfonamide
- IUPAC
- N,3,4-trimethyl-N-(9H-xanthen-9-yl)benzenesulfonamide
Names & synonyms
6320-59-8NSC31228DTXSID50979212N,3,4-Trimethyl-N-(9H-xanthen-9-yl)benzene-1-sulfonamideNSC-31228
Database identifiers
- CAS
6320-59-8- PubChem CID
- 233131
- DTXSID
DTXSID50979212
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 55 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 594
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Compound notes
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