4-[(4-Fluorophenyl)methyl]-2-[1-(2-phenylethyl)azepan-4-yl]phthalazin-1-one

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Catalog Number
ACM110406332
Product Name
4-[(4-Fluorophenyl)methyl]-2-[1-(2-phenylethyl)azepan-4-yl]phthalazin-1-one
Structure
Structure
CAS
110406-33-2
Category
Heterocyclic Organic Compound
Synonyms
1(2H)-Phthalazinone, 4-((4-fluorophenyl)methyl)-2-(hexahydro-1-(2-phenylethyl)-1H-azepin-4-yl)-, monohydrochloride, AC1Q3CCC, SureCN219748, AC1L1T8H, 135381-77-0 (Parent), LS-109263, 4-[(4-fluorophenyl)methyl]-2-(1-phenethylazepan-4-yl)phthalazin-1-one hydrochloride, 110406-33-2
IUPAC Name
4-[(4-fluorophenyl)methyl]-2-[1-(2-phenylethyl)azepan-4-yl]phthalazin-1-one;hydrochloride
Molecular Weight
455.566 g/mol
Molecular Formula
C29H30FN3O
Canonical SMILES
C1CC(CCN(C1)CCC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C(=N3)CC5=CC=C(C=C5)F.Cl
InChI Key
KBNISKYDAJMVNI-UHFFFAOYSA-N
Boiling Point
606.7ºC at 760 mmHg
Flash Point
320.7ºC
Exact Mass
491.21400
H-Bond Acceptor
4
H-Bond Donor
1
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