NDT 9513727
Tocris Bioscience, part of Bio-Techne | Catalog # 3333
Potent, selective human C5a receptor negative allosteric modulator (NAM)
Key Product Details
Description
Potent, selective human C5a receptor negative allosteric modulator (NAM)
Product Description
NDT 9513727 is a potent C5a receptor (C5aR) negative allosteric modulator (NAM) (IC50 = 11.6 nM); selective for human C5aR (IC50 values for rat and mouse C5aR are > 10 μM). Exhibits inverse agonist pharmacokinetics. Blocks degranulation response in C5a-stimulated U937 cells (IC50 = 7.1 nM). Exhibits selectivity for primate and gerbil receptor over other species. Orally bioavailable.Product Specifications
Molecular Weight
573.68
Formula
C36H35N3O4
Storage
Store at +4°C
Purity
≥98% (HPLC)
Chemical Name
N,N-Bis(1,3-benzodioxol-5-ylmethyl)-1-butyl-2,4-diphenyl-1H-Imidazole-5-methanamine
CAS Number
439571-48-9
PubChem ID
10210160
InChI Key
ITACCRHKSPSKKL-UHFFFAOYSA-N
SMILES
CCCCN1C(C6=CC=CC=C6)=NC(C7=CC=CC=C7)=C1CN(CC3=CC(OCO5)=C5C=C3)CC2=CC=C(OCO4)C4=C2
The technical data provided above is for guidance only. For batch specific data refer to the Certificate of Analysis.
Solubility
| Solvent | Max Conc. mg/mL | Max Conc. mM | |
|---|---|---|---|
| Solubility | |||
| DMSO | 57.37 | 100 | |
| Ethanol | 57.37 | 100 |
Preparing Stock Solutions
for NDT 9513727
The following data is based on the product molecular weight 573.68
Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which all affect the solvent volumes required to prepare stock solutions.
| Concentration / Solvent Volume / Mass | 1 mg | 5 mg | 10 mg |
|---|---|---|---|
| 1 mM | 1.74 mL | 8.72 mL | 17.43 mL |
| 5 mM | 0.35 mL | 1.74 mL | 3.49 mL |
| 10 mM | 0.17 mL | 0.87 mL | 1.74 mL |
| 50 mM | 0.03 mL | 0.17 mL | 0.35 mL |
Calculators
Molarity Calculator
Dilution Calculator
Reconstitution Calculator
Background References
References are publications that support the biological activity of the product.
- Robertson Structure of the complement C5a receptor bound to the extra-helical antagonist NDT9513727. Nature 2018 PMID: 29300009
- Brodbeck Identification and characterization of NDT 9513727 [N,N-bis(1,3-benzodioxol-5-ylmethyl)-1-butyl-2,4-diphenyl-1H-imidazole-5-methanamine], a novel, orally bioavailable C5a receptor inverse agonist. J.Pharmacol.Exp.Ther. 2008 PMID: 18753409
Product Specific Notices for NDT 9513727
For research use only
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