Basic information
- Standard SMILES
C[N+]1(Cc2ccc(NC(=O)C3=Cc4cc(-c5ccccc5)ccc4CC3)cc2)CCOCC1- InChIKey
BFQCGODPILXRAA-UHFFFAOYSA-O- Molecular formula
- C29H31N2O2+
- Average molar mass
- 439.6 g/mol
Names & identifiers
- Preferred name
- N-[4-[(4-methylmorpholin-4-ium-4-yl)methyl]phenyl]-7-phenyl-3,4-dihydronaphthalene-2-carboxamide
- IUPAC
- N-[4-[(4-methylmorpholin-4-ium-4-yl)methyl]phenyl]-7-phenyl-3,4-dihydronaphthalene-2-carboxamide
Names & synonyms
CHEMBL65649CHEMBL1179234BDBM50088310N-[4-[(4-methylmorpholin-4-ium-4-yl)methyl]phenyl]-7-phenyl-3,4-dihydronaphthalene-2-carboxamide4-Methyl-4-(4-{[1-(7-phenyl-3,4-dihydronaphthalen-2-yl)-methanoyl]-amino}-benzyl)-morpholin-4-ium4-Methyl-4-{4-[(7-phenyl-3,4-dihydro-naphthalene-2-carbonyl)-amino]-benzyl}-morpholin-4-ium; iodide
Database identifiers
- PubChem CID
- 474151
- ChEMBL
CHEMBL1179234、CHEMBL65649
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 1
- Complexity
- 684
Related reactions
1 records
Compound notes
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