WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 462261
Description: HAT-IN-1 is an inhibitor of HAT, used in the research of cancer.
MedKoo Cat#: 462261
Chemical Formula: C23H18BrF4N3O4
Exact Mass: 555.0417
Molecular Weight: 556.3116
Elemental Analysis: C, 49.66; H, 3.26; Br, 14.36; F, 13.66; N, 7.55; O, 11.50
This product is not in stock, which may be available by custom synthesis.
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IUPAC/Chemical Name: 2-(5'-bromo-2,3',5-trioxo-2',3'-dihydrospiro[imidazolidine-4,1'-inden]-1-yl)-N-(4-fluorobenzyl)-N-((S)-1,1,1-trifluoropropan-2-yl)acetamide
InChi Key: UCICQLJZEXBBBY-BJDAYTSDSA-N
InChi Code: InChI=1S/C23H18BrF4N3O4/c1-12(23(26,27)28)30(10-13-2-5-15(25)6-3-13)19(33)11-31-20(34)22(29-21(31)35)9-18(32)16-8-14(24)4-7-17(16)22/h2-8,12H,9-11H2,1H3,(H,29,35)/t12-,22?/m0/s1
SMILES Code: FC1=CC=C(CN(C(CN2C(C3(C(C=CC(Br)=C4)=C4C(C3)=O)NC2=O)=O)=O)[C@@H](C)C(F)(F)F)C=C1
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
The following data is based on the product molecular weight 556.3116 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: Michael Michaelides, et al. Spirocyclic hat inhibitors and methods for their use.