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Rolapitant

CAS 552292-08-7C25H26F6N2O2MW 500.5

Rolapitant (CAS 552292-08-7) — formula C25H26F6N2O2, molecular weight 500.5; category organic chemicals.

Product Overview

CAS Number552292-08-7
Molecular FormulaC25H26F6N2O2
Molecular Weight500.5
LogP4.4
CategoryOrganic Chemicals

Technical Profile

What this product is

Rolapitant is a carbon-based organic compound with CAS registry number 552292-08-7 and molecular formula C25H26F6N2O2 (molecular weight 500.5), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 552292-08-7

Its molecular formula C25H26F6N2O2 comprises 25 C, 26 H, 6 F, 2 N, 2 O atoms.

Also known as: Rolapitant · 罗拉吡坦

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Rolapitant?

The CAS registry number of Rolapitant is 552292-08-7.

What is the molecular formula and molecular weight of Rolapitant?

Molecular formula C25H26F6N2O2, molecular weight 500.5.

What other names is Rolapitant known by?

It is also registered under: Rolapitant, 罗拉吡坦.

Which category does Rolapitant belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for Rolapitant (CAS 552292-08-7), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number552292-08-7
PubChem CID10311306
Molecular formulaC25H26F6N2O2
IUPAC name(5S,8S)-8-[[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]methyl]-8-phenyl-1,9-diazaspiro[4.5]decan-2-one
UNII (FDA)NLE429IZUC

Computed descriptors

Molecular Weight500.5
XLogP34.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass500.18984705
Monoisotopic Mass500.18984705
Topological Polar Surface Area50.4
Heavy Atom Count35

Documented uses on record

    This drug is indicated in adults in combination with other antiemetics for the prevention of delayed nausea and vomiting associated with emetogenic chemotherapy.Rolapitant is an orally available antiemetic agent that is used to prevent cancer chemotherapy related nausea and vomiting. Rolapitant therapy has not been associated with serum enzyme elevations or with instances of clinically apparent liver injury with jaundice.

    Synonyms and trade names

    Rolapitant; 552292-08-7; NLE429IZUC; Varuby; (5S,8S)-8-[[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]methyl]-8-phenyl-1,9-diazaspiro[4.5]decan-2-one; CHEBI:90908; A04AD14; DTXSID90203740; (5S,8S)-8-(((1R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)methyl)-8-phenyl-1,7-diazaspiro(4.5)decan-2-one; (5S,8S)-8-({(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy}methyl)-8-phenyl-1,7-diazaspiro[4.5]decan-2-one; (5S,8S)-8-{[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]methyl}-8-phenyl-1,7-diazaspiro[4.5]decan-2-one; 1,7-DIAZASPIRO(4.5)DECAN-2-ONE, 8-(((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)METHYL)-8-PHENYL-, (5S,8S)-; rolapitantum; (5S,8S)-8-(((1R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)methyl)-8-phenyl-1,9-diazaspiro(4.5)decan-2-one; RefChem:57237; DTXCID20126231

    GHS hazard classification

    Reported hazard statementsH361 (100%)

    H361 (100%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]

    P203, P280, P318, P405, and P501 (click each P-code to see the statement)

    What the public record says

    Rolapitant · CAS 552292-08-7 · C25H26F6N2O2. UNII NLE429IZUC.

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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Supplier: Jinan Shenghe Chemical Co., Ltd.

中文页面: 罗拉吡坦

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