Basic information
- CAS
5431-04-9- Standard SMILES
CCN(CC)CCCC(C)Nc1ccnc2ccc(Oc3ccccc3)cc12- InChIKey
YZERXGOIZQSVOM-UHFFFAOYSA-N- Molecular formula
- C24H31N3O
- Average molar mass
- 377.5 g/mol
- Monoisotopic mass
- 377.24671262
Names & identifiers
- Preferred name
- N,N-Diethyl-N-(6-phenoxyquinolin-4-YL)pentane-1,4-diamine
- IUPAC
- 1-N,1-N-diethyl-4-N-(6-phenoxyquinolin-4-yl)pentane-1,4-diamine
Names & synonyms
NSC13478NSC-134785431-04-9DS-011772N,N-DIETHYL-N-(6-PHENOXYQUINOLIN-4-YL)PENTANE-1,4-DIAMINE
Database identifiers
- CAS
5431-04-9- PubChem CID
- 224740
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 422
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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