2-(4-Methoxyphenyl)sulfonyl-4-methylbenzo[h]quinoline
Basic information
- CAS
81009-00-9- Standard SMILES
COc1ccc(S(=O)(=O)c2cc(C)c3ccc4ccccc4c3n2)cc1- InChIKey
OWHHCMRUHDMMAH-UHFFFAOYSA-N- Molecular formula
- C21H17NO3S
- Average molar mass
- 363.4 g/mol
- Monoisotopic mass
- 363.09291458
Names & identifiers
- Preferred name
- 2-(4-Methoxyphenyl)sulfonyl-4-methylbenzo[h]quinoline
- IUPAC
- 2-(4-methoxyphenyl)sulfonyl-4-methylbenzo[h]quinoline
Names & synonyms
81009-00-92-(4-methoxyphenyl)sulfonyl-4-methylbenzo[h]quinolineNSC357565DTXSID80320298NSC-3575652-(4-Methoxybenzene-1-sulfonyl)-4-methylbenzo[h]quinoline
Database identifiers
- CAS
81009-00-9- PubChem CID
- 337822
- DTXSID
DTXSID80320298
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 579
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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