FXIa-6f | CAS#1551459-37-0 | Inhibitor

MedKoo Cat#: 208217 | Name: FXIa-6f

Description:

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

FXIa-6f is a high affinity, orally bioavailable macrocyclic FXIa inhibitor with antithrombotic activity in preclinical species

Chemical Structure

FXIa-6f

CAS#1551459-37-0

Theoretical Analysis

MedKoo Cat#: 208217

Name: FXIa-6f

CAS#: 1551459-37-0

Chemical Formula: C31H29ClF2N4O4

Exact Mass: 594.1845

Molecular Weight: 595.04

Elemental Analysis: C, 62.57; H, 4.91; Cl, 5.96; F, 6.39; N, 9.42; O, 10.75

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.

Bulk Inquiry

Related CAS #

No Data

Synonym

FXIa6f, F-XIa6f, FX-Ia-6f, FXIa-IN-6f; Factor XIa inhibitor 6f

IUPAC/Chemical Name

Methyl N-[(10R,14S)-14-[4-(3-chloro-2,6-difluorophenyl)-6-oxo-2,3-dihydropyridin-1-yl]-10-methyl-9-oxo-8,16-diazatricyclo[13.3.1.02,7]nonadeca-1(19),2(7),3,5,15,17-hexaen-5-yl]carbamate

InChi Key

AXXYATYQRMPQSN-QUGAMOGWSA-N

InChi Code

InChI=1S/C31H29ClF2N4O4/c1-17-4-3-5-26(38-13-11-19(15-27(38)39)28-23(33)9-8-22(32)29(28)34)25-14-18(10-12-35-25)21-7-6-20(36-31(41)42-2)16-24(21)37-30(17)40/h6-10,12,14-17,26H,3-5,11,13H2,1-2H3,(H,36,41)(H,37,40)/t17-,26+/m1/s1

SMILES Code

O=C(OC)NC1=CC(NC([C@H](C)CCC[C@@H]2N(CCC(C3=C(F)C=CC(Cl)=C3F)=C4)C4=O)=O)=C(C=C1)C5=CC2=NC=C5

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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 595.04 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

Chacko SA, Yang W, Wang Y, Tian Y, Hong Y, Wallace M, Wang B, Ewing WR, Luettgen JM, Shu YZ, Christopher LJ. Preclinical metabolism and disposition of an orally bioavailable macrocyclic FXIa inhibitor. Xenobiotica. 2021 Aug;51(8):933-948. doi: 10.1080/00498254.2021.1943565. Epub 2021 Jul 5. PMID: 34151691.