MedKoo Cat#: 565147 | Name: BIO-0554019

Description:

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

BIO-0554019 is a selective RORgamma inhibitor which selectively inhibits Th17 differentiation and RORgamma signature gene expression.

Chemical Structure

BIO-0554019
BIO-0554019
CAS#NONE

Theoretical Analysis

MedKoo Cat#: 565147

Name: BIO-0554019

CAS#: NONE

Chemical Formula: C26H18D3Cl3F3N3O4

Exact Mass: 604.0738

Molecular Weight: 605.83

Elemental Analysis: C, 51.55; H, 3.99; Cl, 17.55; F, 9.41; N, 6.94; O, 10.56

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.
Bulk Inquiry
Related CAS #
No Data
Synonym
BIO0554019; BIO-0554019; BIO 0554019
IUPAC/Chemical Name
2,6-Dichloro-N-(4-(5-chloro-2-(3-hydroxypyrrolidine-1-carbonyl)pyridin-4-yl)-2-(2,2,2-trifluoroethoxy)phenyl)-N-(methyl-d3)benzamide
InChi Key
BIQZLFVNKOMFOX-FIBGUPNXSA-N
InChi Code
InChI=1S/C26H21Cl3F3N3O4/c1-34(25(38)23-17(27)3-2-4-18(23)28)21-6-5-14(9-22(21)39-13-26(30,31)32)16-10-20(33-11-19(16)29)24(37)35-8-7-15(36)12-35/h2-6,9-11,15,36H,7-8,12-13H2,1H3/i1D3
SMILES Code
O=C(N(C1=CC=C(C2=CC(C(N3CC(O)CC3)=O)=NC=C2Cl)C=C1OCC(F)(F)F)C([2H])([2H])[2H])C4=C(Cl)C=CC=C4Cl
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

Preparing Stock Solutions

The following data is based on the product molecular weight 605.83 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: Banerjee D, Zhao L, Wu L, Palanichamy A, Ergun A, Peng L, Quigley C, Hamann S, Dunstan R, Cullen P, Allaire N, Guertin K, Wang T, Chao J, Loh C, Fontenot JD. Small molecule mediated inhibition of RORγ-dependent gene expression and autoimmune disease pathology in vivo. Immunology. 2016 Apr;147(4):399-413. doi: 10.1111/imm.12570. Epub 2016 Jan 26. PubMed PMID: 26694902; PubMed Central PMCID: PMC4799885.