4-methoxy-N-[3-(prop-2-enylamino)quinoxalin-2-yl]benzenesulfonamide
Basic information
- CAS
716335-22-7- Standard SMILES
C=CCNc1nc2ccccc2nc1NS(=O)(=O)c1ccc(OC)cc1- InChIKey
CRZCJYLOQHPTQR-UHFFFAOYSA-N- Molecular formula
- C18H18N4O3S
- Average molar mass
- 370.4 g/mol
- Monoisotopic mass
- 370.10996162
Names & identifiers
- Preferred name
- 4-methoxy-N-[3-(prop-2-enylamino)quinoxalin-2-yl]benzenesulfonamide
- IUPAC
- 4-methoxy-N-[3-(prop-2-enylamino)quinoxalin-2-yl]benzenesulfonamide
Names & synonyms
4-methoxy-N-[3-(prop-2-enylamino)quinoxalin-2-yl]benzenesulfonamide716335-22-7MLS001215077CHEMBL1415150DTXSID201325833HMS2863K22STL051641AKOS005704563AKOS032388213SMR000543091N-(3-(allylamino)quinoxalin-2-yl)-4-methoxybenzenesulfonamideN-[3-(allylamino)-2-quinoxalinyl]-4-methoxybenzenesulfonamide
Show more names
4-methoxy-N-[(2Z)-3-(prop-2-en-1-ylamino)quinoxalin-2(1H)-ylidene]benzenesulfonamide4-Methoxy-N-{3-[(prop-2-en-1-yl)amino]quinoxalin-2-yl}benzene-1-sulfonamide
Database identifiers
- CAS
716335-22-7- PubChem CID
- 1636052
- DTXSID
DTXSID201325833- ChEMBL
CHEMBL1415150
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 557
Experimental & physicochemical properties
Solubility45.9 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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