Basic information
- CAS
145124-30-7- Standard SMILES
CS(=O)(=O)O.CS(=O)(=O)O.C[C@H](CNCCNC[C@@H](C)N1C(=O)c2cccc3cc([N+](=O)[O-])cc(c23)C1=O)N1C(=O)c2cccc3cc([N+](=O)[O-])cc(c23)C1=O- InChIKey
KPQJSSLKKBKWEW-RKDOVGOJSA-N- Molecular formula
- C34H36N6O14S2
- Average molar mass
- 816.8 g/mol
- Monoisotopic mass
- 816.17309219
Overview
Bisnafide Dimesylate is the dimesylate salt form of bisnafide, a bis-naphthalimide compound with anticancer activity. Bisnafide selectively intercalates guanine-cytosine (GC) rich regions of DNA, thereby interfering with DNA replication machinery and activity of topoisomerase II. As a result, this agent causes potent cytotoxicity.
Names & identifiers
- Preferred name
- Bisnafide Dimesylate
- IUPAC
- methanesulfonic acid;5-nitro-2-[(2R)-1-[2-[[(2R)-2-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]amino]ethylamino]propan-2-yl]benzo[de]isoquinoline-1,3-dione
Names & synonyms
BISNAFIDE DIMESYLATE145124-30-7Bisnafide dimesilateDMP-840VersalumaJ30IBO0LMADTXSID901628831H-Benz(de)isoquinoline-1,3(2H)-dione, 2,2'-(1,2-ethanediylbis(imino(1-methyl-2,1-ethanediyl)))bis(5-nitro-, (R-(R*,R*))-, dimethanesulfonateRefChem:1080029DTXCID5085374Bisnafide mesylateDmp 840
Show more names
Bisnafide dimesylate [USAN]NSC-D640430N,N'-(Ethylenebis(imino((R)-1-methylethylene)))bis(3-nitronaphthalimide)dimethanesulfonateBisnafide dimesylate (USAN)methanesulfonic acid;5-nitro-2-[(2R)-1-[2-[[(2R)-2-(5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]amino]ethylamino]propan-2-yl]benzo[de]isoquinoline-1,3-dione(R,R)-2,2'-(1,2-ethanediylbis(imino(1-methyl-2,1-ethanediyl)))-bis(5-nitro-1H-benz(de)isoquinolone-1,3-(2H)-dione)dimethanesulfonateUNII-J30IBO0LMABisnafide mesilate
Database identifiers
- CAS
145124-30-7- PubChem CID
- 60916
- DTXSID
DTXSID90162883- ChEMBL
CHEMBL46803- UNII
- J30IBO0LMA
Properties
Computed structural properties
- Topological polar surface area
- 316 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 9
- Heavy atoms
- 56
- Formal charge
- 0
- Complexity
- 1,250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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