NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-(2-chloroacetyl)-2-[(2-chloroethyl)amino]-1,3,2λ5-oxazaphosphinan-2-one
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IUPAC Traditional name
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3-(2-chloroacetyl)-2-[(2-chloroethyl)amino]-1,3,2λ5-oxazaphosphinan-2-one
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Synonyms
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2-Chloro-1-[2-[(2-chloroethyl)amino]dihydro-2-oxido-2H-1,3,2-oxazaphosphorin-3(4H)-yl]ethanone
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3-(Chloroacetyl)-N-(2-chloroethyl)tetrahydro-2H-1,3,2-oxazaphosphorin-2-amine 2-Oxide
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2'-Oxo Ifosfamide
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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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11.905385
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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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-0.26566625
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LogD (pH = 7.4)
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-0.26567814
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Log P
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-0.2656661
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Molar Refractivity
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58.5572 cm3
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Polarizability
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23.549757 Å3
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Polar Surface Area
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58.64 Å2
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Rotatable Bonds
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4
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
TRC
PATENTS
PATENTS
PubChem Patent
Google Patent