NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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7-methyl-1H,2H,3H-pyrido[2,3-b][1,4]oxazin-2-one
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IUPAC Traditional name
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7-methyl-1H,3H-pyrido[2,3-b][1,4]oxazin-2-one
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Synonyms
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7-Methyl-1H-pyrido[2,3-b][1,4]oxazin-2(3H)-one
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7-methyl-1H,2H,3H-pyrido[2,3-b][1,4]oxazin-2-one
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7-Methyl-1H-pyrido[2,3-b][1,4]oxazin-2(3H)-one
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CAS Number
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MDL 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
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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10.863309
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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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0.64421856
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LogD (pH = 7.4)
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0.6446709
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Log P
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0.64482045
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Molar Refractivity
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44.0229 cm3
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Polarizability
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16.066805 Å3
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Polar Surface Area
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51.22 Å2
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Rotatable Bonds
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0
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
Sigma Aldrich
Sigma Aldrich -
ADE001276
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Other Notes Please note that Sigma-Aldrich does not collect analytical data for AldrichCPR products and that all sales are final.All AldrichCPR products, and other building blocks or screening compounds that are part of this collection, are also available as custom packaged libraries - for more details about this service or for further information on this product, please contact us at AldrichCPR@sial.com Legal Information Product of Adesis |
PATENTS
PATENTS
PubChem Patent
Google Patent