ChemicalBook--->CAS DataBase List--->138449-07-7

138449-07-7

138449-07-7 Structure

138449-07-7 Structure
IdentificationBack Directory
[Name]

FK 888
[CAS]

138449-07-7
[Synonyms]

FK 888
FK888 hydrate
N(2)-(4-Hydroxy-1-(1-methyl-1H-indol-3-yl)carbonyl-L-prolyl)-N-methyl-N-phenylmethyl-3-(2-naphthyl)-L-alaninamide
(4R)-4-Hydroxy-1-[(1-methyl-1H-indol-3-yl)carbonyl]-L-prolyl-N-methyl-3-(2-naphthalenyl)-N-(phenylmethyl)-L-alaninamide
L-Alaninamide, (4R)-4-hydroxy-1-((1-methyl-1H-indol-3-yl)carbonyl)-L-prolyl-N-methyl-3-(2-naphthalenyl)-N-(phenylmethyl)-
L-Alaninamide, trans-4-hydroxy-1-((1-methyl-1H-indol-3-yl)carbonyl)-L-prolyl-N-methyl-3-(2-naphthalenyl)-N-(phenylmethyl)-
N2-[(4R)-4-hydroxyl-1-(1-methyl-1H-indol-3-yl)carbonyl-L-prolyl]-N-methyl-N-phenylmethyl-3-(2-naphthyl)-L-alaninamide hydrate
(4R)-4-Hydroxy-1-[(1-methyl-1H-indol-3-yl)carbonyl]-L-prolyl-N-methyl-3-(2-naphthalenyl)-N-(phenylmethyl)-L-alaninamide hydrate
[Molecular Formula]

C36H36N4O4
[MDL Number]

MFCD00274042
[MOL File]

138449-07-7.mol
[Molecular Weight]

588.7
Chemical PropertiesBack Directory
[Boiling point ]

901.9±65.0 °C(Predicted)
[density ]

1.26±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO: ≥13mg/mL
[form ]

powder
[pka]

13.01±0.40(Predicted)
[color ]

white to tan
[optical activity]

[α]/D -135 to -145°, c = 1 in methanol
Safety DataBack Directory
[WGK Germany ]

3
Hazard InformationBack Directory
[Uses]

FK 888 is a neurokinin NK1 receptor antagonist, which is active both in vivo and in vitro.
[Definition]

ChEBI: (2S,4R)-4-hydroxy-1-[(1-methyl-3-indolyl)-oxomethyl]-N-[(2S)-1-[methyl-(phenylmethyl)amino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-2-pyrrolidinecarboxamide is a peptide.
[Biological Activity]

Selective, high affinity tachykinin NK 1 receptor antagonist (K i = 0.69 nM) that displays 320-fold selectivity for human over rat NK 1 receptors. Inhibits substance P-induced contraction of isolated guinea pig trachea (IC 50 = 32 nM) and inhibits substance P-induced airway constriction in vivo following i.v. and oral administration.
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

FK 888(138449-07-7)MS
FK 888(138449-07-7)IR1
FK 888(138449-07-7)IR2
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