Basic information
- CAS
6633-14-3- Standard SMILES
Br.CCCC(C)NCCNc1cc(OC)cc2cccnc12- InChIKey
KMXRKTIMUGEDJC-UHFFFAOYSA-N- Molecular formula
- C17H26BrN3O
- Average molar mass
- 368.3 g/mol
- Monoisotopic mass
- 367.12593
Names & identifiers
- Preferred name
- N~1~-(6-Methoxyquinolin-8-yl)-N~2~-(pentan-2-yl)ethane-1,2-diamine--hydrogen bromide (1/1)
- IUPAC
- N-(6-methoxyquinolin-8-yl)-N'-pentan-2-ylethane-1,2-diamine;hydrobromide
Names & synonyms
6633-14-3DTXSID60713487NSC56643NSC-56643N~1~-(6-Methoxyquinolin-8-yl)-N~2~-(pentan-2-yl)ethane-1,2-diamine--hydrogen bromide (1/1)
Database identifiers
- CAS
6633-14-3- PubChem CID
- 54603003
- DTXSID
DTXSID60713487
Properties
Computed structural properties
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 287
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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