Products 170729-80-3

CAS 170729-80-3 appears in our catalog under these names: Aprepitant, Aprepitant, >95% (HPLC), Aprepitant/ 99.9%, Aprepitant - Bio-X â„¢, Aprepitant, >98.0%(HPLC). Offered by: Chemat Brand, TRC, Mikromol, TargetMol, GLPBio. Available pack sizes: on request, 100mg, 10mg, 25mg, 250mg, 5mg, 50mg, 200mg.

Aprepitant
Chemat Brand, Mikromol, GLPBio
  • size: on request, 250mg, 100mg, 25mg
  • Variants: 13
from 663.71
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Aprepitant, >95% (HPLC)
TRC
  • size: 100mg, 10mg, 25mg
  • Variants: 3
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Aprepitant/ 99.9%
TargetMol
  • size: 5mg, 10mg, 50mg, 100mg
  • Variants: 6
from 499.07
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Aprepitant - Bio-X â„¢
Biosynth
  • size: 50mg
  • Variants: 1
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Aprepitant, >98.0%(HPLC)
TCI
  • size: 100mg, 500mg
  • Variants: 2
from 334.70
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Aprepitant, 98.00%
Chemat
  • size: 1g, 250mg
  • Variants: 2
from 842.53
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5-[2(R)-[1(R)-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3(S)-(4-fluorophenyl)morpholin-4-ylmethyl]-3,4-dihydro-2H-1,2,4-triazol-3-one, 98%, 98%
Chemat
  • size: 50mg
  • Variants: 1
from 93.20
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Aprepitant, 99.82%
MedChemExpress
  • size: 500 mg, 5 mg, 100 mg, 10mM/1mL
  • Variants: 7
from 435.79
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Aprepitant (Standard)
MedChemExpress
  • size: 10 mg, 5 mg, 50 mg, 100 mg
  • Variants: 5
from 751.58
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Aprepitant, BioScience Grade, 50 mg
Roth
  • size: 50mg
  • Variants: 1
from 514.44
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Aprepitant, 98%
Ambeed
  • size: 250mg, 1g, 5g, 25g
  • Variants: 4
from 186.81
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5-[2(R)-[1(R)-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-3(S)-(4-fluorophenyl)morpholin-4-ylmethyl]-3,4-dihydro-2H-1,2,4-triazol-3-one, 98%
Chemat, Fluorochem
  • size: 1mg, 5mg, 10mg, 250mg
  • Variants: 15
from 83.60
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5-(((2R,3S)-2-((R)-1-(3,5-Bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)morpholino)methyl)-1H-1,2,4-triazol-3(2H)-one, 98%
BLDpharm
  • size: 250mg, 1g, 5g, 25g
  • Variants: 4
from 136.64
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Aprepitant, European Pharmacopoeia (EP)
Sigma-Aldrich
  • size: -
  • Variants: 1
from 695.70
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Aprepitant for system suitability, europ
Sigma-Aldrich
  • size: -
  • Variants: 1
from 695.70
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Structural formula: {0} (CAS {1})

Aprepitant is a morpholine-based antiemetic, which is or the prevention of acute and delayed nausea and vomiting associated with initial and repeat courses of highly emetogenic cancer chemotherapy. Aprepitant is a selective high-affinity antagonist of human substance P/neurokinin 1 (NK1) receptors. It has a role as an antidepressant, a peripheral nervous system drug, an antiemetic, a neurokinin-1 receptor antagonist and a substance P receptor antagonist. It is a member of triazoles, a member of morpholines, a cyclic acetal and a member of (trifluoromethyl)benzenes.

Source: ChEBI

Identity
Molecular formulaC23H21F7N4O3
Molecular weight534.4 g/mol
IUPAC name3-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one
InChIKeyATALOFNDEOCMKK-OITMNORJSA-N
SMILESC[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@@H]2[C@@H](N(CCO2)CC3=NNC(=O)N3)C4=CC=C(C=C4)F

Computed by PubChem (NCBI)

Synonyms: Aprepitant, Cinvanti, Aponvie, aprepitantum, Emend, Aprepitant [USAN]
Related forms of this compound
3-[[(2S,3S)-2-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one C23H21F7N4O3
3-[[(2S,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one C23H21F7N4O3
3-[[(2S,3R)-2-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one C23H21F7N4O3
3-[[(2R,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one C23H21F7N4O3
3-[[(2R,3R)-2-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one C23H21F7N4O3
3-[[(2S,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one C23H21F7N4O3
3-[[(2R,3S)-2-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one C23H21F7N4O3
3-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]-1,2-dideuterioethoxy]-3-(4-fluorophenyl)morpholin-4-yl](113C)methyl]-(313C)1,4-dihydro-1,2,4-triazol-5-one C23H21F7N4O3
Isomers (same molecular formula)
3-[[(2R,3S)-2-[(1R)-1-[4-fluoro-3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-phenylmorpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one C23H21F7N4O3
3-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(3-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one C23H21F7N4O3