9-Chloro-12-methoxynaphtho[2,3-c]acridine-5,8,14(13h)-trione
Basic information
- CAS
57468-12-9- Standard SMILES
COc1ccc(Cl)c2c(=O)c3ccc4c(c3[nH]c12)C(=O)c1ccccc1C4=O- InChIKey
HFZJNDDQCAPETD-UHFFFAOYSA-N- Molecular formula
- C22H12ClNO4
- Average molar mass
- 389.8 g/mol
- Monoisotopic mass
- 389.0454856
Names & identifiers
- Preferred name
- 9-Chloro-12-methoxynaphtho[2,3-c]acridine-5,8,14(13h)-trione
- IUPAC
- 9-chloro-12-methoxy-13H-naphtho[2,3-c]acridine-5,8,14-trione
Names & synonyms
57468-12-99-chloro-12-methoxynaphtho[2,3-c]acridine-5,8,14(13h)-trioneNSC135530DTXSID40972994NSC-135530
Database identifiers
- CAS
57468-12-9- PubChem CID
- 282273
- DTXSID
DTXSID40972994
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 72.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 696
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Compound notes
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