Bentysrepinine

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

MedKoo CAT#: 527418

CAS#: 934264-38-7

Description: Bentysrepinine, also known as Y-101, is a novel anti-HBV agent inhibiting DNA-HBV and cccDNA activities for the treatment of hepatitis B virus (HBV)-infected hepatitis.

Chemical Structure

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Bentysrepinine
CAS# 934264-38-7
Instruction

Theoretical Analysis

MedKoo Cat#: 527418
Name: Bentysrepinine
CAS#: 934264-38-7
Chemical Formula: C29H35N3O4
Exact Mass: 489.26
Molecular Weight: 489.616
Elemental Analysis: C, 71.14; H, 7.21; N, 8.58; O, 13.07

Price and Availability

This product is not in stock, which may be available by custom synthesis. For cost-effective reason, minimum order is 1g (price is usually high, lead time is 2~3 months, depending on the technical challenge). Quote less than 1g will not be provided. To request quote, please email to sales @medkoo.com or click below button.
Note: Price will be listed if it is available in the future.

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Synonym: Bentysrepinine; Y101; Y-101; Y 101

IUPAC/Chemical Name: N-((S)-3-(4-(2-(dimethylamino)ethoxy)phenyl)-1-(((S)-1-hydroxy-3-phenylpropan-2-yl)amino)-1-oxopropan-2-yl)benzamide

InChi Key: XWEMGJQQCSSGPN-BDYUSTAISA-N

InChi Code: InChI=1S/C29H35N3O4/c1-32(2)17-18-36-26-15-13-23(14-16-26)20-27(31-28(34)24-11-7-4-8-12-24)29(35)30-25(21-33)19-22-9-5-3-6-10-22/h3-16,25,27,33H,17-21H2,1-2H3,(H,30,35)(H,31,34)/t25-,27-/m0/s1

SMILES Code: O=C(N[C@@H](CC1=CC=C(OCCN(C)C)C=C1)C(N[C@@H](CC2=CC=CC=C2)CO)=O)C3=CC=CC=C3

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:

Biological target:
In vitro activity:
In vivo activity:

Preparing Stock Solutions

The following data is based on the product molecular weight 489.62 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
Formulation protocol:
In vitro protocol:
In vivo protocol:

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1: Fan H, Li R, Gu Y, Si D, Liu C. Quantitation of bentysrepinine (Y101) in rat plasma by liquid chromatography tandem mass spectrometry: application to pharmacokinetic study. J Chromatogr B Analyt Technol Biomed Life Sci. 2012 Mar 15;889-890:103-9. doi: 10.1016/j.jchromb.2012.02.002. PubMed PMID: 22366283.

2: Fan H, Hu Z, Li R, Dong S, Gu Y, Liu T, Si D, Liang G, Liu C. Metabolite identification of bentysrepinine (Y101), a novel anti-HBV agent in rats using a five-step strategy based on a combined workflow with two different platforms of liquid chromatography-tandem mass spectrometry. J Chromatogr B Analyt Technol Biomed Life Sci. 2017 Jan 1;1040:118-128. doi: 10.1016/j.jchromb.2016.12.008. PubMed PMID: 27978466.