Basic information
- CAS
5340-00-1- Standard SMILES
COc1cc(NCCCCCCN2CCNCC2)c2ncccc2c1.O=C(O)C(=O)O- InChIKey
UWMHFQKUJFQNCM-UHFFFAOYSA-N- Molecular formula
- C22H32N4O5
- Average molar mass
- 432.5 g/mol
- Monoisotopic mass
- 432.23727013
Names & identifiers
- Preferred name
- 6-methoxy-N-(6-piperazin-1-ylhexyl)quinolin-8-amine; oxalic acid
- IUPAC
- 6-methoxy-N-(6-piperazin-1-ylhexyl)quinolin-8-amine;oxalic acid
Names & synonyms
NSC36075340-00-1DTXSID40277698NSC-36076-methoxy-N-(6-piperazin-1-ylhexyl)quinolin-8-amine; oxalic acid58969-47-4Oxalic acid--6-methoxy-N-[6-(piperazin-1-yl)hexyl]quinolin-8-amine (1/1)
Database identifiers
- CAS
5340-00-1、58969-47-4- PubChem CID
- 220620
- DTXSID
DTXSID40277698
Properties
Computed structural properties
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 433
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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