Alvimopan

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Names

[ CAS No. ]:
170098-38-1

[ Name ]:
Alvimopan

[Synonym ]:
Alvimopan dihydrate
Alvimopan
N-{(2S)-2-Benzyl-3-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl]propanoyl}glycine dihydrate
Glycine, N-[(2S)-3-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl]-1-oxo-2-(phenylmethyl)propyl]-, hydrate (1:2)
Alvimopan (USAN)
Adl 8-2698
Alvimopan anhydrous
UNII-677C126AET
Alvimopan hydrate
Entereg
Alvimopan (dihydrate)

Chemical & Physical Properties

[ Density]:
1.166g/cm3

[ Boiling Point ]:
684.1ºC at 760mmHg

[ Melting Point ]:
210-213ºC

[ Molecular Formula ]:
C25H36N2O6

[ Molecular Weight ]:
460.563

[ Flash Point ]:
367.5ºC

[ Exact Mass ]:
460.257324

[ PSA ]:
108.33000

[ LogP ]:
3.25160

[ Vapour Pressure ]:
1.18E-19mmHg at 25°C

[ Index of Refraction ]:
1.572

[ Storage condition ]:
-20℃

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MC0595275
CHEMICAL NAME :
Glycine, N-(2-((4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl )methyl)-1-oxo-3-phen ylpropyl)-,dihydrate, (3R-(1(S*),3-alpha,4-alpha))-
CAS REGISTRY NUMBER :
170098-38-1
LAST UPDATED :
199606
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C25-H32-N2-O4.2H2-O
MOLECULAR WEIGHT :
460.63

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 19,1078,1994
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>20 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 19,1078,1994
TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 19,1078,1994

Related Compounds

  • Alvimopan
  • ALVIMOPAN
  • Alvimopan-d5
  • Alvimopan monohydrate
  • Alvimopan metabolite-d5
  • Alvimopan Intermediate 1
  • 1-Bromo-3-fluoro-2-(trichloromethoxy)benzene
  • 2-[Chloro(difluoro)methoxy]-1-fluoro-4-nitro-benzene
  • Methyl 3-(2-methoxyphenyl)-2-methylbenzoate
  • 1-Fluoro-4-nitro-2-(trifluoromethoxy)benzene
  • [(3R,4S,5S,6R)-5-methoxy-4-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl] 2-aminoacetate
  • 3-(3-Bromo-4-propan-2-yloxyphenyl)pentane-2,4-dione
  • 2-(tetrazol-1-yl)-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine
  • 1-[6-Ethyl-1-(2-methoxy-ethyl)-4,4-dimethyl-1,2,3,4-tetrahydro-quinolin-7-yl]-ethanone
  • 1-(6-Ethyl-4,4-dimethyl-1-phenyl-1,2,3,4-tetrahydro-quinolin-7-yl)-ethanone
  • Methyl 2-[4-(3-fluorophenyl)phenyl]acetate
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