KW 4099 | CAS# 141364-05-8 | Thromboxane A2 antagonist

MedKoo Cat#: 414274 | Name: KW 4099

Description:

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

KW 4099 is a thromboxane A2 antagonist.

Chemical Structure

KW 4099

CAS#141364-05-8

Theoretical Analysis

MedKoo Cat#: 414274

Name: KW 4099

CAS#: 141364-05-8

Chemical Formula: C29H30NNaO3S

Exact Mass: 495.1844

Molecular Weight: 495.61

Elemental Analysis: C, 70.28; H, 6.10; N, 2.83; Na, 4.64; O, 9.68; S, 6.47

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

KW 4099; KW4099; KW-4099

IUPAC/Chemical Name

Dibenz(b,e)oxepin-2-carboxylic acid, 6,11-dihydro-11-((2-(4-(phenylmethyl)-1-piperidinyl)ethyl)thio)-, sodium salt, (+-)-

InChi Key

FOJFFNXERATJEW-UHFFFAOYSA-M

InChi Code

InChI=1S/C29H31NO3S.Na/c31-29(32)23-10-11-27-26(19-23)28(25-9-5-4-8-24(25)20-33-27)34-17-16-30-14-12-22(13-15-30)18-21-6-2-1-3-7-21;/h1-11,19,22,28H,12-18,20H2,(H,31,32);/q;+1/p-1

SMILES Code

O=C(C1=CC=C2OCC3=CC=CC=C3C(SCCN4CCC(CC5=CC=CC=C5)CC4)C2=C1)[O-].[Na+]

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 495.61 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: Kuge Y, Shioga K, Sugaya T, Tomioka S. Enzymatic optical resolution of dibenzoxepins and its application to an optically active antiallergic agent with thromboxane A2 receptor antagonistic activity. Biosci Biotechnol Biochem. 1993 Jul;57(7):1157-60. doi: 10.1271/bbb.57.1157. PMID: 7763987. 2: Sugaya T, Kuge Y, Tomioka S, Tamaki K. Synthesis and optical resolution of an antiallergic agent KW4099 with thromboxane A2 antagonistic activity. Chem Pharm Bull (Tokyo). 1992 Jan;40(1):238-9. doi: 10.1248/cpb.40.238. PMID: 1576677.