Methanesulfonanilide, 4'-(4-(2,3-dihydroxypropyl)carbamoyl-9-acridinylamino)-3'-methoxy-, hydrochloride
Basic information
- CAS
63178-52-9- Standard SMILES
COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2c(C(=O)NCC(O)CO)cccc12.Cl- InChIKey
QYSSBGCIXXQLLK-UHFFFAOYSA-N- Molecular formula
- C25H27ClN4O6S
- Average molar mass
- 547 g/mol
- Monoisotopic mass
- 546.1339835
Names & identifiers
- Preferred name
- Methanesulfonanilide, 4'-(4-(2,3-dihydroxypropyl)carbamoyl-9-acridinylamino)-3'-methoxy-, hydrochloride
- IUPAC
- N-(2,3-dihydroxypropyl)-9-[4-(methanesulfonamido)-2-methoxyanilino]acridine-4-carboxamide;hydrochloride
Names & synonyms
4'-(4-(2,3-Dihydroxypropyl)carbamoyl-9-acridinylamino)-3'-methoxymethanesulfonanilide HCl63178-52-9Methanesulfonanilide, 4'-(4-(2,3-dihydroxypropyl)carbamoyl-9-acridinylamino)-3'-methoxy-, hydrochlorideRefChem:352327CHEMBL3251879DTXSID10979157N-(2,3-Dihydroxypropyl)-9-[4-(methanesulfonamido)-2-methoxyanilino]acridine-4-carboximidic acid--hydrogen chloride (1/1)N-(2,3-Dihydroxypropyl)-9-{4-[(methanesulfonyl)amino]-2-methoxyanilino}acridine-4-carboximidic acid--hydrogen chloride (1/1)
Database identifiers
- CAS
63178-52-9- PubChem CID
- 3047271
- DTXSID
DTXSID10979157- ChEMBL
CHEMBL3251879
Properties
Computed structural properties
- Topological polar surface area
- 158 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 839
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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