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MedKoo Cat#: 577035 | Name: MDL-73669

Description:

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

MDL-73669 is a macrocyclic HIV-protease inhibitor that contains a difluorostatone peptide mimetic.

Chemical Structure

MDL-73669
MDL-73669
CAS#155398-83-7

Theoretical Analysis

MedKoo Cat#: 577035

Name: MDL-73669

CAS#: 155398-83-7

Chemical Formula: C38H39F2N3O6

Exact Mass: 671.2807

Molecular Weight: 671.74

Elemental Analysis: C, 67.95; H, 5.85; F, 5.66; N, 6.26; O, 14.29

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
MDL 73669; MDL73669; MDL-73669
IUPAC/Chemical Name
Carbamic acid, (1-(((3,3-difluoro-2,4-dioxo-1-((4-(phenylmethoxy)phenyl)methyl)-4-((phenylmethyl)amino)butyl)amino)carbonyl)-2-methylpropyl)-, phenylmethyl ester, (S-(R*,R*))-
InChi Key
WJSVMBNINJAEAH-LQJZCPKCSA-N
InChi Code
InChI=1S/C38H39F2N3O6/c1-26(2)33(43-37(47)49-25-30-16-10-5-11-17-30)35(45)42-32(34(44)38(39,40)36(46)41-23-28-12-6-3-7-13-28)22-27-18-20-31(21-19-27)48-24-29-14-8-4-9-15-29/h3-21,26,32-33H,22-25H2,1-2H3,(H,41,46)(H,42,45)(H,43,47)/t32-,33-/m0/s1
SMILES Code
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc2ccc(OCc3ccccc3)cc2)C(=O)C(F)(F)C(=O)NCc4ccccc4
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 671.74 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. Podlogar BL, Farr RA, Friedrich D, Tarnus C, Huber EW, Cregge RJ, Schirlin D. Design, synthesis, and conformational analysis of a novel macrocyclic HIV-protease inhibitor. J Med Chem. 1994 Oct 28;37(22):3684-92. doi: 10.1021/jm00048a004. PMID: 7966128.