Amsacrine mesylate
Basic information
- CAS
54301-16-5- Standard SMILES
COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2ccccc12.CS(=O)(=O)O- InChIKey
KIDGPIWSXHBPDH-UHFFFAOYSA-N- Molecular formula
- C22H23N3O6S2
- Average molar mass
- 489.6 g/mol
- Monoisotopic mass
- 489.10282781
Names & identifiers
- Preferred name
- Amsacrine mesylate
- IUPAC
- N-[4-(acridin-9-ylamino)-3-methoxyphenyl]methanesulfonamide;methanesulfonic acid
Names & synonyms
Amsacrine mesylate54301-16-5UNII-7LWQ0T63UA7LWQ0T63UANSC 154948N-(4-(9-Acridinylamino)-3-methoxyphenyl)methanesulfonamide methanesulfonateAMSACRINE MESILATENSC-154948DTXSID702026704'-(9-Acridinylamino)-3'-methoxymethanesulfonanilide methanesulfonateMethanesulfonanilide, 4'-(9-acridinylamino)-3'-methoxy-, methanesulfonateMethanesulfonamide, N-(4-(9-acridinylamino)-3-methoxyphenyl)-, monomethanesulfonate
Show more names
AMSACRINE METHANESULFONATE [MI]METHANESULFONAMIDE, N-(4-(9-ACRIDINYLAMINO)-3-METHOXYPHENYL)-, METHANESULFONATE (1:1)RefChem:112360AMSACRINE METHANESULFONATEDTXCID00125161CI-880 methylsulfonateN-[4-(acridin-9-ylamino)-3-methoxyphenyl]methanesulfonamide;methanesulfonic acidCHEMBL3229103
Database identifiers
- CAS
54301-16-5- PubChem CID
- 148674
- DTXSID
DTXSID70202670- ChEMBL
CHEMBL3229103- UNII
- 7LWQ0T63UA
Properties
Computed structural properties
- Topological polar surface area
- 151 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 693
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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