PSB1114 | CAS#1657025-60-9 |P2Y2 agonist

MedKoo Cat#: 532480 | Name: PSB1114

Description:

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

PSB1114 is a potent, selective P2Y2 agonist (EC50 = 0.134 μM). PSB1114 displays >60-fold selectivity versus P2Y4 and P2Y6 receptors.

Chemical Structure

PSB1114

CAS#1657025-60-9

Theoretical Analysis

MedKoo Cat#: 532480

Name: PSB1114

CAS#: 1657025-60-9

Chemical Formula: C10H15F2N2O13P3S

Exact Mass: 533.9476

Molecular Weight: 534.21

Elemental Analysis: C, 22.48; H, 2.83; F, 7.11; N, 5.24; O, 38.93; P, 17.39; S, 6.00

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

PSB1114; PSB 1114; PSB-1114.

IUPAC/Chemical Name

({[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-oxo-4-sulfanylidene-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}difluoromethyl)phosphonic acid

InChi Key

DFGBPSGNGNHNQM-XVFCMESISA-N

InChi Code

InChI=1S/C10H15F2N2O13P3S/c11-10(12,28(18,19)20)29(21,22)27-30(23,24)25-3-4-6(15)7(16)8(26-4)14-2-1-5(31)13-9(14)17/h1-2,4,6-8,15-16H,3H2,(H,21,22)(H,23,24)(H,13,17,31)(H2,18,19,20)/t4-,6-,7-,8-/m1/s1

SMILES Code

FC(P(O)(OP(O)(OC[C@H]1O[C@@H](N(C(N2)=O)C=CC2=S)[C@H](O)[C@@H]1O)=O)=O)(P(O)(O)=O)F

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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 534.21 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.

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. El-Tayeb et al (2011) Structural modifications of UMP, UDP, and UTP leading to subtype-selective agonists for P2Y2, P2Y4, and P2Y6 receptors. J.Med.Chem. 54 2878. PMID: 21417463.