WARNING: This product is for research use only, not for human or veterinary use.
Hodoodo CAT#: H124817
CAS#: 2334472-62-5 (tris)
Description: Clesacostat, also known PF-05221304, is a potent and selective ACC inhibitor (hACC1 IC50 = 13nM; hACC@ IC50 = 9 nM). PF-0522130 selectively inhibits liver DNL in animals, while demonstrating considerable safety margins against platelet reduction in a nonhuman primate model.
Hodoodo Cat#: H124817
Name: Clesacostat tromethamine
CAS#: 2334472-62-5 (tris)
Chemical Formula: C32H41N5O8
Exact Mass: 623.30
Molecular Weight: 623.710
Elemental Analysis: C, 61.62; H, 6.63; N, 11.23; O, 20.52
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Related CAS #: 1370448-25-1 (free) 2334472-62-5 (tris) 2334472-64-7 (tris hydrate)
Synonym: Clesacostat tromethamine; PF-05221304 tromethamine; QF09CQF4SR; Clesacostat tromethamine [USAN]; 2334472-62-5
IUPAC/Chemical Name: 2-amino-2-(hydroxymethyl)propane-1,3-diol 4-(4-(1-isopropyl-7-oxo-1,4,6,7-tetrahydrospiro[indazole-5,4'-piperidine]-1'-carbonyl)-6-methoxypyridin-2-yl)benzoate
InChi Key: XFSXWQKSSSEPDH-UHFFFAOYSA-N
InChi Code: InChI=1S/C28H30N4O5.C4H11NO3/c1-17(2)32-25-21(16-29-32)14-28(15-23(25)33)8-10-31(11-9-28)26(34)20-12-22(30-24(13-20)37-3)18-4-6-19(7-5-18)27(35)36;5-4(1-6,2-7)3-8/h4-7,12-13,16-17H,8-11,14-15H2,1-3H3,(H,35,36);6-8H,1-3,5H2
SMILES Code: CC(C)N1C2=C(CC3(CCN(CC3)C(=O)C4=CC(=NC(=C4)OC)C5=CC=C(C=C5)C(=O)O)CC2=O)C=N1.C(C(CO)(CO)N)O
Appearance: To be determined
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:
Biological target: | |
In vitro activity: | |
In vivo activity: |
The following data is based on the product molecular weight 623.71 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 |
Formulation protocol: | |
In vitro protocol: | |
In vivo protocol: |