Fobrepodacin | CAS#1384984-31-9 | phosphate prodrug

MedKoo Cat#: 462319 | Name: Fobrepodacin

Description:

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

Fobrepodacin, also known as SPR720 or pVXc-486, is an orally active and potent phosphate prodrug of SPR719. SPR720 has potent bactericidal activities in vivo.

Chemical Structure

Fobrepodacin

CAS#1384984-31-9 (free base)

Theoretical Analysis

MedKoo Cat#: 462319

Name: Fobrepodacin

CAS#: 1384984-31-9 (free base)

Chemical Formula: C21H26FN6O6P

Exact Mass: 508.1635

Molecular Weight: 508.45

Elemental Analysis: C, 49.61; H, 5.15; F, 3.74; N, 16.53; O, 18.88; P, 6.09

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 #

1384984-20-6 (disodium) 1384984-31-9 (free base) 1536471-76-7 (sodium)

Synonym

SPR720; SPR-720; SPR 720; pVXc-486; pVXc 486; pVXc486; Fobrepodacin;

IUPAC/Chemical Name

(R)-2-(5-(2-(3-ethylureido)-6-fluoro-7-(tetrahydrofuran-2-yl)-1H-benzo[d]imidazol-5-yl)pyrimidin-2-yl)propan-2-yl dihydrogen phosphate

InChi Key

COTQDURISRILOR-CQSZACIVSA-N

InChi Code

InChI=1S/C21H26FN6O6P/c1-4-23-20(29)28-19-26-13-8-12(16(22)15(17(13)27-19)14-6-5-7-33-14)11-9-24-18(25-10-11)21(2,3)34-35(30,31)32/h8-10,14H,4-7H2,1-3H3,(H2,30,31,32)(H3,23,26,27,28,29)/t14-/m1/s1

SMILES Code

O=C(NC1=NC2=CC(C3=CN=C(C(OP(O)(O)=O)(C)C)N=C3)=C(F)C([C@@H]4OCCC4)=C2N1)NCC

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

2934.99.9001

More Info

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 508.45 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: Locher CP, Jones SM, Hanzelka BL, et al. A novel inhibitor of gyrase B is a potent drug candidate for treatment of tuberculosis and nontuberculosis mycobacterial infections. Antimicrob Agents Chemother. 2015;59(3):1455-1465. doi:10.1128/AAC.04347-14