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MedKoo Cat#: 563926 | Name: NWL-117

Description:

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

NWL-117 is an irreversible caspase inhibitor. NWL-117 displays a higher selectivity against Caspase-6, -4, -8, -9, and -10.

Chemical Structure

NWL-117
NWL-117
CAS#NONE

Theoretical Analysis

MedKoo Cat#: 563926

Name: NWL-117

CAS#: NONE

Chemical Formula: C29H42N4O11S

Exact Mass: 654.2571

Molecular Weight: 654.73

Elemental Analysis: C, 53.20; H, 6.47; N, 8.56; O, 26.88; S, 4.90

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
NWL-117 ; NWL117 ; NWL 117
IUPAC/Chemical Name
(5S,8S,11S,14R)-11-((S)-sec-Butyl)-8-(2-carboxyethyl)-5-isopropyl-14-((E)-2-(methylsulfonyl)vinyl)-3,6,9,12-tetraoxo-1-phenyl-2-oxa-4,7,10,13-tetraazapentadecan-15-oic acid
InChi Key
VEKNUYSRYFYBQI-ITUQAALSSA-N
InChi Code
InChI=1S/C29H42N4O11S/c1-6-18(4)24(27(38)31-21(28(39)40)14-15-45(5,42)43)32-25(36)20(12-13-22(34)35)30-26(37)23(17(2)3)33-29(41)44-16-19-10-8-7-9-11-19/h7-11,14-15,17-18,20-21,23-24H,6,12-13,16H2,1-5H3,(H,30,37)(H,31,38)(H,32,36)(H,33,41)(H,34,35)(H,39,40)/b15-14+/t18-,20-,21+,23-,24-/m0/s1
SMILES Code
O=C(O)[C@@H](/C=C/S(=O)(C)=O)NC([C@H]([C@@H](C)CC)NC([C@H](CCC(O)=O)NC([C@H](C(C)C)NC(OCC1=CC=CC=C1)=O)=O)=O)=O
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
>3 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
2934.99.03.00
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 654.73 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: Pakavathkumar P, Noël A, Lecrux C, Tubeleviciute-Aydin A, Hamel E, Ahlfors JE, LeBlanc AC. Caspase vinyl sulfone small molecule inhibitors prevent axonal degeneration in human neurons and reverse cognitive impairment in Caspase-6-overexpressing mice. Mol Neurodegener. 2017 Feb 28;12(1):22. doi: 10.1186/s13024-017-0166-z. PubMed PMID: 28241839; PubMed Central PMCID: PMC5329948.