MedKoo Cat#: 466252 | Name: DS69910557

Description:

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

DS69910557 is an oral hPTHR1 GPCR antagonist. It exhibits calcium-lowering activity in rodents.

Chemical Structure

DS69910557
DS69910557
CAS#unknown

Theoretical Analysis

MedKoo Cat#: 466252

Name: DS69910557

CAS#: unknown

Chemical Formula: C32H33Cl2FN4O3

Exact Mass: 610.1914

Molecular Weight: 611.54

Elemental Analysis: C, 62.85; H, 5.44; Cl, 11.59; F, 3.11; N, 9.16; O, 7.85

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
DS69910557; DS 69910557; DS-69910557;
IUPAC/Chemical Name
(1r,4r)-4-(((1-(4-(2,9-dichloro-5,5-dimethyl-6-oxo-5,6-dihydro-7H-benzo[b]pyrido[3,2-d]azepin-7-yl)phenyl)-3-fluoroazetidin-3-yl)methyl)amino)cyclohexane-1-carboxylic acid
InChi Key
JAOGFYSXDYNYSX-XYWHTSSQSA-N
InChi Code
InChI=1S/C32H33Cl2FN4O3/c1-31(2)28-26(13-21(34)15-36-28)25-12-5-20(33)14-27(25)39(30(31)42)24-10-8-23(9-11-24)38-17-32(35,18-38)16-37-22-6-3-19(4-7-22)29(40)41/h5,8-15,19,22,37H,3-4,6-7,16-18H2,1-2H3,(H,40,41)/t19-,22-
SMILES Code
O=C(O)[C@@H]1CC[C@@H](NCC2(F)CN(C3=CC=C(N4C(C=C(Cl)C=C5)=C5C(C=C(Cl)C=N6)=C6C(C)(C)C4=O)C=C3)C2)CC1
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
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

Preparing Stock Solutions

The following data is based on the product molecular weight 611.54 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: Arai Y, Kiyotsuka Y, Nagamochi M, Oyama K, Izumi M. Lead optimization of pyrido[2,3-d][1]benzazepin-6-one derivatives leading to the discovery of a potent, selective, and orally available human parathyroid hormone receptor 1 (hPTHR1) antagonist (DS69910557). Bioorg Med Chem. 2022 Jun 15;64:116763. doi: 10.1016/j.bmc.2022.116763. Epub 2022 Apr 22. PMID: 35487102.