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Netupitant

Structure via PubChem · Public domain (PubChem)

EntityQ19598139· pop 5· linked from 80 articles

Netupitant

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Also known as Ro 67-31898/000, Ro-673189000, 2-[3,5-Bis(trifluoromethyl)phenyl]-N,2-dimethyl-N-[4-(2-methylphenyl)-6-(4-methyl-1-piperazinyl)-3-pyridinyl]propanamide

senyawa kimia

Chemical data

Formula
C30H32F6N4O
Molecular weight
578.6 g/mol
IUPAC name
2-[3,5-bis(trifluoromethyl)phenyl]-N,2-dimethyl-N-[4-(2-methylphenyl)-6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide
SMILES
CC1=CC=CC=C1C2=CC(=NC=C2N(C)C(=O)C(C)(C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N4CCN(CC4)C
InChIKey
WAXQNWCZJDTGBU-UHFFFAOYSA-N
XLogP
6.8
Polar surface area
39.7 Ų
H-bond donors
0
H-bond acceptors
10
Formal charge
0

via PubChem

Drug data · ChEMBL

Max clinical phase
Approved
Molecule type
Small molecule
First approval
2014
Admin. routes
oral
Indications
Chemotherapy-induced nausea and vomiting, cancer

via ChEMBL · EBI

Wikidata facts

Mass
578.248031
Has use
medication
Show 4 more facts
chemical formula
C₃₀H₃₂F₆N₄O
canonical SMILES
CC1=CC=CC=C1C2=CC(=NC=C2N(C)C(=O)C(C)(C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N4CCN(CC4)C
World Health Organisation international non-proprietary name
netupitant
Commons category
Netupitant
Sources (3)

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via Wikidata sitelinks · CC0