NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(3R)-N-(propan-2-yl)-3-[(propan-2-yl)(propyl)amino]-3,4-dihydro-2H-1-benzopyran-5-carboxamide
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IUPAC Traditional name
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Synonyms
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CAS Number
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PubChem SID
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PubChem CID
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Chemspider ID
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Unique Ingredient Identifier
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Wikipedia Title
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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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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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14.974215
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H Acceptors
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3
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H Donor
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1
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LogD (pH = 5.5)
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0.23166327
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LogD (pH = 7.4)
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1.8234848
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Log P
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3.4342873
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Molar Refractivity
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95.1026 cm3
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Polarizability
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36.65655 Å3
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Polar Surface Area
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41.57 Å2
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Rotatable Bonds
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6
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Lipinski's Rule of Five
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true
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PROPERTIES
PROPERTIES
Pharmacology Properties
Bioassay(PubChem)
Admin Routes
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Oral
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Show
data source
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Legal Status
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Uncontrolled
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Show
data source
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DETAILS
DETAILS
Wikipedia
PATENTS
PATENTS
PubChem Patent
Google Patent