NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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methyl (2S)-2-({[4-(2-cyanophenyl)phenyl]methyl}amino)pentanoate
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IUPAC Traditional name
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methyl (2S)-2-({[4-(2-cyanophenyl)phenyl]methyl}amino)pentanoate
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Synonyms
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N-[(2'-Cyano[1,1'-biphenyl]-4-yl)methyl]-L-valine Methyl Ester
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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
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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3.4801822
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LogD (pH = 7.4)
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4.172316
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Log P
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4.1946487
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Molar Refractivity
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94.6364 cm3
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Polarizability
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38.33375 Å3
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Polar Surface Area
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62.12 Å2
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Rotatable Bonds
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8
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Lipinski's Rule of Five
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true
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PROPERTIES
PROPERTIES
Safety Information
Product Information
Bioassay(PubChem)
DETAILS
DETAILS
TRC
Toronto Research Chemicals -
C962340
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N-[(2'-Cyano[1,1'-biphenyl]-4-yl)methyl]-L-valine Methyl Ester is an intermediate in the preparation of angiotensin II type 1 receptor antagonists. |
PATENTS
PATENTS
PubChem Patent
Google Patent