Methanesulfonamide, 1-(p-(9-acridinylamino)phenyl)-N-(2-pyridyl)-
Basic information
- CAS
66147-72-6- Standard SMILES
O=S(=O)(Cc1ccc(Nc2c3ccccc3nc3ccccc23)cc1)Nc1ccccn1- InChIKey
XYADFDBJIZKXBS-UHFFFAOYSA-N- Molecular formula
- C25H20N4O2S
- Average molar mass
- 440.5 g/mol
- Monoisotopic mass
- 440.13069707
Names & identifiers
- Preferred name
- Methanesulfonamide, 1-(p-(9-acridinylamino)phenyl)-N-(2-pyridyl)-
- IUPAC
- 1-[4-(acridin-9-ylamino)phenyl]-N-pyridin-2-ylmethanesulfonamide
- English name
- α-[p-(9-Acridinylamino)phenyl]-N-(2-pyridyl)methanesulfonamide
- Molecular formula
- C25H20N4O2S
- Molecular weight
- 440.52
Names & synonyms
BRN 0458341Methanesulfonamide, 1-(p-(9-acridinylamino)phenyl)-N-(2-pyridyl)-66147-72-61-(p-(9-Acridinylamino)phenyl)-N-(2-pyridyl)methanesulfonamideCHEMBL107947DTXSID402163451-{4-[(acridin-9-yl)amino]phenyl}-N-(pyridin-2-yl)methanesulfonamideBenzenemethanesulfonamide, 4-(9-acridinylamino)-N-2-pyridinyl-α-[p-(9-Acridinylamino)phenyl]-N-(2-pyridyl)methanesulfonamide
Database identifiers
- CAS
66147-72-6- PubChem CID
- 152606
- DTXSID
DTXSID40216345- ChEMBL
CHEMBL107947- Nikkaji
- J62.560D
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 681
Physicochemical properties
- Boiling point
- 663.4 · 663.4±65.0 °C(Predicted)
- Density
- 1.414 · 1.414±0.06 g/cm3(Predicted)
- pka
- 7.44 · 7.44±0.10(Predicted)
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Related reactions
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Compound notes
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