NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(5E)-2,2-dimethyl-7-[methyl(naphthalen-1-ylmethyl)amino]hept-5-en-3-yn-1-ol
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IUPAC Traditional name
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(5E)-2,2-dimethyl-7-[methyl(naphthalen-1-ylmethyl)amino]hept-5-en-3-yn-1-ol
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Synonyms
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(5E)-2,2-Dimethyl-7-[methyl(1-naphthalenylmethyl)amino]-5-hepten-3-yn-1-ol
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Hydroxy Terbinafine
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CAS Number
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PubChem SID
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PubChem CID
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
Data Source
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Data ID
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Price
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TRC
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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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17.145563
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H Acceptors
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2
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H Donor
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1
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LogD (pH = 5.5)
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1.0772005
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LogD (pH = 7.4)
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2.6976986
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Log P
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4.2467117
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Molar Refractivity
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99.8499 cm3
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Polarizability
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39.04012 Å3
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Polar Surface Area
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23.47 Å2
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Rotatable Bonds
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7
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
TRC
Toronto Research Chemicals -
H956160
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A metabolite of Terbinafine, an orally active, antimycotic allylamine related to naftifine. A specfic inhibitor of squalene epoxidase, a key enzyme in fungal ergosterol biosynthesis. |
REFERENCES
REFERENCES
From Suppliers
Google Scholar
PubMed
Google Books
- • Gazinger, U., et al.: Proc. 13th Int. Congr. Chemother., 6, 116/52 (1983)
- • Shadomy, S., et al.: Sabouraudia, 23, 125 (1983)
- • Evans, E.G.V., et al.: Brit. Med. J., 318, 1031 (1999)
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PATENTS
PATENTS
PubChem Patent
Google Patent