N-[[4-(aminomethyl)phenyl]methyl]-6-methoxy-5-(4-methoxyphenoxy)quinolin-8-amine
Basic information
- CAS
61895-52-1- Standard SMILES
COc1ccc(Oc2c(OC)cc(NCc3ccc(CN)cc3)c3ncccc23)cc1- InChIKey
CHWFXBQLQWJIOK-UHFFFAOYSA-N- Molecular formula
- C25H25N3O3
- Average molar mass
- 415.5 g/mol
- Monoisotopic mass
- 415.18959167
Names & identifiers
- Preferred name
- N-[[4-(aminomethyl)phenyl]methyl]-6-methoxy-5-(4-methoxyphenoxy)quinolin-8-amine
- IUPAC
- N-[[4-(aminomethyl)phenyl]methyl]-6-methoxy-5-(4-methoxyphenoxy)quinolin-8-amine
Names & synonyms
NSC290954MLS00311563261895-52-1SMR001831204N-[[4-(aminomethyl)phenyl]methyl]-6-methoxy-5-(4-methoxyphenoxy)quinolin-8-amineCHEMBL1907512BDBM89222cid_6451076[4-(aminomethyl)benzyl]-[6-methoxy-5-(4-methoxyphenoxy)-8-quinolyl]amine;fumaric acidN-[[4-(aminomethyl)phenyl]methyl]-6-methoxy-5-(4-methoxyphenoxy)-8-quinolinamine;(E)-2-butenedioic acidN-[[4-(aminomethyl)phenyl]methyl]-6-methoxy-5-(4-methoxyphenoxy)quinolin-8-amine;(E)-but-2-enedioic acid
Database identifiers
- CAS
61895-52-1- PubChem CID
- 324707
- ChEMBL
CHEMBL1907512- Nikkaji
- J557.333E
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 78.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 520
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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