Maropitant Citrate (HCID 204107)

Überblick

Maropitant Citrate is a neurokinin receptor antagonist with antiemetic activity. This agent is approved for veterinary use only.

Namen und Bezeichner

Bevorzugter Name: Maropitant Citrate
IUPAC: (2S,3S)-2-benzhydryl-N-[(5-tert-butyl-2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
Englischer Name: Maropitant citrate hydrate
Summenformel: C38H48N2O8
Molmasse: 660.81

Namen und Synonyme

Maropitant citrate359875-09-5Maropitant citrate hydrateCereniaCJ-11,972MAROPITANT CITRATE MONOHYDRATELXN6S3999XCJ-119721-Azabicyclo(2.2.2)octan-3-amine, N-((5-(1,1-dimethylethyl)-2-methoxyphenyl)methyl)-2-(diphenylmethyl)-, (2S,3S)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1), monohydrate(2S,3S)-N-(5-(1,1-Dimethylethyl)-2-methoxybenzyl)-2-(diphenylmethyl)-1-azabicyclo(2.2.2)octan-3-amine 2-hydroxy-1,2,3-propanetricarboxylate (1:1), monohydrateCeritantEmeprev

Weitere Namen anzeigen

2-HYDROXYPROPANE-1,2,3-TRICARBOXYLIC ACIDFEMA 2306Maropitan citrateethyl[(1R)-1-[(2R)-oxolan-2-yl]-2-phenylethyl]amine4-(4-fluorophenyl)-1-[4-(1,2,4-triazol-1-yl)butyl]-3,6-dihydro-2H-pyridine(7S,8S)-7-benzhydryl-N-[(2-methoxy-5-tert-butyl-phenyl)methyl]-1-azabicyclo[2.2.2]octan-8-amineACIDUM CITRICUM ANHYDRICUM

ComforTrateComfor-trate(2S,3S)-N-[5-(1,1-Dimethylethyl)-2-methoxybenzyl]-2-(diphenylmethyl)-1-azabicyclo[2.2.2]octan-3-amine 2-hydroxy-1,2,3-propanetricarboxylate (1:1), monohydrateRefChem:56960(2S,3S)-2-benzhydryl-N-(5-(tert-butyl)-2-methoxybenzyl)quinuclidin-3-amine 2-hydroxypropane-1,2,3-tricarboxylate hydrateMaropitant citrate [USAN]Maropitant citrate (USAN)(2S,3S)-2-Benzhydryl-N-[(5-tert-butyl-2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine Citrate Hydrate

Datenbank-Bezeichner

CAS: 359875-09-5
PubChem CID: 204107
DTXSID: DTXSID70957411
ChEMBL: CHEMBL2107353
UNII: LXN6S3999X
EC Number: 837-630-8

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 158 Å²
H-Brücken-Donoren: 6
H-Brücken-Akzeptoren: 11
Frei drehbare Bindungen: 13
Schwere Atome: 49
Formalladung: 0
Komplexität: 848

Experimentelle und physikochemische Eigenschaften

Animal Drugs · 3 Einträge

EMA approved medicines: Veterinary medicine

Physikochemische Eigenschaften

Schmelzpunkt: 153 · 153-159 °C(lit.)
Flammpunkt: 100 °C · 100 °C
storage temp.: 2 · 2-8°C
Löslichkeit: 2 O: · H2O: 1 M at 20 °C, clear, colorless
Aggregatzustand: white to off-white crystalline powder
Wasserlöslichkeit: 3 mg/mL · Water: 3 mg/mL (4.42 mM)
Major Application: agricultureenvironmentalfood and beverages || microbiology
InChIKey: XDZPFSKCXRGRIO-OHTRWSNQNA-N
SMILES: C(O)(C(=O)O)(CC(=O)O)CC(=O)O.C(C1C=CC=CC=1)(C1C=CC=CC=1)[C@@H]1N2CCC(CC2)[C@@H]1NCC1C=C(C(C)(C)C)C=CC=1OC |&1:26,33,r|
CAS Datenbank: 359875 · 359875-09-5(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H317 (50%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P260, P261, P264+P265, P272, P273, P280, P302+P352, P305+P351+P338, P305+P354+P338, P317, P319, P321, P333+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Sens. 1 (50%)

Sicherheitsdaten

F: 9
wgk: 1
ridadr: UN 3284 6.1/PG 3
RTECS-Nr.: GE7350000
risk_code: 41-42/43-36/37/38-25
hazard_code: Xi,T
safety_code: 26-39-45-36/37-22
Speicherklasse: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard Classifications: Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2Skin Sens. 1

Chemie und Industrie

Pharmakologische Informationen

MeSH Pharmacological ClassificationDrugs used to prevent NAUSEA or VOMITING.

Anwendungen · 2 Einträge

BeschreibungMaropitant citrate hydrate is a specific neurokinin-1 (NK-1) receptor antagonist that selectively inhibits the production of substance P, a mediator involved in signalling vomiting. Maropitant citrate was therefore originally used to treat vomiting in dogs and cats. Currently, it is also used as an adjunct to visceral analgesia in dogs and cats, and in other species such as horses and birds.

VerwendenAnti-emetic.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

(2S,3S)-2-Benzhydryl-N-(5-tert-butyl-2-Methoxybenzyl)quinuclidin-3-aMine Zitronensure

Anbieter50 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

山东科立康药业有限公司053-88113608 17854192669

湖北威德利化学试剂有限公司181-6332-1995 18062128043 · [email protected]

武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]

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