MedKoo Cat#: 528601 | Name: ONO-2952

Description:

WARNING: This product is for research use only, not for human or veterinary use.

ONO-2952 is a peripheral benzodiazepine receptor antagonist potentially for the treatment of irritable bowel syndrome.

Chemical Structure

ONO-2952
ONO-2952
CAS#895169-20-7

Theoretical Analysis

MedKoo Cat#: 528601

Name: ONO-2952

CAS#: 895169-20-7

Chemical Formula: C22H20ClFN2O2

Exact Mass: 398.1197

Molecular Weight: 398.86

Elemental Analysis: C, 66.25; H, 5.05; Cl, 8.89; F, 4.76; N, 7.02; O, 8.02

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
ONO-2952; ONO2952; ONO 2952
IUPAC/Chemical Name
(S)-1-(1'-(4-chloro-2-methoxyphenyl)-5'-fluoro-1',9'-dihydrospiro[cyclopropane-1,4'-pyrido[3,4-b]indol]-2'(3'H)-yl)ethan-1-one
InChi Key
ZBQMTQGDBFZUBG-NRFANRHFSA-N
InChi Code
CC(N(C[15:S=N]HC[19]()=CC=C(Cl)C=C@19OC)CC[2](C[7]()=C(@15)NC[14]=C@8C(F)=CC=C@14)CC@3)=O
SMILES Code
CC(N([C@H]1C2=CC=C(Cl)C=C2OC)CC3(C4=C1NC5=C4C(F)=CC=C5)CC3)=O
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 398.86 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Frankle WG, Narendran R, Wood AT, Suto F, Himes ML, Kobayashi M, Ohno T, Yamauchi A, Mitsui K, Duffy K, Bruce M. Brain translocator protein occupancy by ONO-2952 in healthy adults: A Phase 1 PET study using [(11) C]PBR28. Synapse. 2017 Feb 28. doi: 10.1002/syn.21970. [Epub ahead of print] PubMed PMID: 28245513. 2: Mitsui K, Niwa T, Kawahara Y, Morimoto N, Ohmoto K, Kato M, Yamaura Y, Yoshimoto N, Suna H, Katsumata S. Anti-stress effects of ONO-2952, a novel translocator protein 18 kDa antagonist, in rats. Neuropharmacology. 2015 Dec;99:51-66. doi: 10.1016/j.neuropharm.2015.07.011. Epub 2015 Jul 17. PubMed PMID: 26189762. 3: Suto F, Wood AT, Kobayashi M, Komaba J, Duffy K, Bruce M. Safety, Tolerability, and Pharmacokinetic Profile of the Novel Translocator Protein 18 kDa Antagonist ONO-2952 in Healthy Volunteers. Clin Ther. 2015 Sep;37(9):2071-84. doi: 10.1016/j.clinthera.2015.07.010. Epub 2015 Aug 4. PubMed PMID: 26249232. 4: Mitsui K, Morimoto N, Niwa T, Yamaura Y, Ohba H, Tsukada H, Katsumata S. Quantification of ONO-2952 Occupancy of 18-kDaTranslocator Protein in Conscious Monkey Brains using Positron Emission Tomography. J Pharmacol Exp Ther. 2017 Mar;360(3):457-465. doi: 10.1124/jpet.116.238568. Epub 2016 Dec 16. PubMed PMID: 27986860. 5: Whitehead WE, Duffy K, Sharpe J, Nabata T, Bruce M. Randomised clinical trial: exploratory phase 2 study of ONO-2952 in diarrhoea-predominant irritable bowel syndrome. Aliment Pharmacol Ther. 2017 Jan;45(1):14-26. doi: 10.1111/apt.13839. Epub 2016 Nov 7. PubMed PMID: 27910150. 6: Nee J, Lembo A. Editorial: ONO-2952 in irritable bowel syndrome with diarrhoea. Aliment Pharmacol Ther. 2017 Apr;45(7):1004-1005. doi: 10.1111/apt.13920. PubMed PMID: 28256084. 7: Whitehead WE, Duffy K, Sharpe J, Nabata T, Bruce M. Editorial: ONO-2952 in irritable bowel syndrome with diarrhoea - authors' reply. Aliment Pharmacol Ther. 2017 Apr;45(7):1005. doi: 10.1111/apt.13957. PubMed PMID: 28256085.