Basic information
- CAS
85455-57-8- Standard SMILES
Nc1cccc(C(=O)Nc2ccc3c(O)c(N=Nc4ccc5ccccc5c4)c(S(=O)(=O)O)cc3c2)c1.[Na]- InChIKey
CHLWNZFQTGOLEK-UHFFFAOYSA-N- Molecular formula
- C27H20N4NaO5S
- Average molar mass
- 535.5 g/mol
- Monoisotopic mass
- 535.10521021
Names & identifiers
- Preferred name
- CID 170846292
Database identifiers
- CAS
85455-57-8- PubChem CID
- 170846292
Properties
Computed structural properties
- Topological polar surface area
- 163 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 940
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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