Methanesulfonamide, N-(4-((3,6-dinitro-9-acridinyl)amino)-3-methoxyphenyl)-
Basic information
- CAS
59748-50-4- Standard SMILES
COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccc([N+](=O)[O-])cc2nc2cc([N+](=O)[O-])ccc12- InChIKey
WQZIQJRBPMUVEW-UHFFFAOYSA-N- Molecular formula
- C21H17N5O7S
- Average molar mass
- 483.5 g/mol
- Monoisotopic mass
- 483.08486907
Names & identifiers
- Preferred name
- Methanesulfonamide, N-(4-((3,6-dinitro-9-acridinyl)amino)-3-methoxyphenyl)-
- IUPAC
- N-[4-[(3,6-dinitroacridin-9-yl)amino]-3-methoxyphenyl]methanesulfonamide
Names & synonyms
Methanesulfonamide, N-(4-((3,6-dinitro-9-acridinyl)amino)-3-methoxyphenyl)-59748-50-4N-(4-((3,6-Dinitro-9-acridinyl)amino)-3-methoxyphenyl)methanesulfonamideCHEMBL107100DTXSID30208456N-{4-[(3,6-Dinitroacridin-9-yl)amino]-3-methoxyphenyl}methanesulfonamide
Database identifiers
- CAS
59748-50-4- PubChem CID
- 5488078
- DTXSID
DTXSID30208456- ChEMBL
CHEMBL107100
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 180 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 819
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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