MedKoo Cat#: 465355 | Name: ZY12201

Description:

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

ZY12201 is a novel potent and orally bioavailable TGR5 agonist.

Chemical Structure

ZY12201
ZY12201
CAS#unknown

Theoretical Analysis

MedKoo Cat#: 465355

Name: ZY12201

CAS#: unknown

Chemical Formula: C31H31FN4O3S

Exact Mass: 558.2101

Molecular Weight: 558.67

Elemental Analysis: C, 66.65; H, 5.59; F, 3.40; N, 10.03; O, 8.59; S, 5.74

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
ZY12201; ZY 12201; ZY-12201;
IUPAC/Chemical Name
2-((2-(4-(1H-imidazol-1-yl)phenoxy)ethyl)thio)-5-(2-(3,4-dimethoxyphenyl)propan-2-yl)-1-(4-fluorophenyl)-1H-imidazole
InChi Key
ZRQBEFYILDBORB-UHFFFAOYSA-N
InChi Code
InChI=1S/C31H31FN4O3S/c1-31(2,22-5-14-27(37-3)28(19-22)38-4)29-20-34-30(36(29)25-8-6-23(32)7-9-25)40-18-17-39-26-12-10-24(11-13-26)35-16-15-33-21-35/h5-16,19-21H,17-18H2,1-4H3
SMILES Code
FC1=CC=C(N2C(C(C)(C3=CC=C(OC)C(OC)=C3)C)=CN=C2SCCOC4=CC=C(N5C=CN=C5)C=C4)C=C1
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
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
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 558.67 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: Sojitra C, Dholakia C, Sudhakar P, Singh KK, Agarwal S. Identification of degradation impurity of TGR5 receptor agonist-ZY12201 by LC-MS technique during force degradation study. SN Appl Sci. 2021;3(6):660. doi: 10.1007/s42452-021-04660-y. Epub 2021 May 25. PMID: 34056545; PMCID: PMC8144688.