HTL0029881 | CAS#N/A | CGRP antagonist

MedKoo Cat#: 130149 | Name: HTL0029881

Description:

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

HTL0029881 is a CGRP antagonist.

Chemical Structure

HTL0029881

CAS#N/A

Theoretical Analysis

MedKoo Cat#: 130149

Name: HTL0029881

CAS#: N/A

Chemical Formula: C35H36N6O5

Exact Mass: 620.2747

Molecular Weight: 620.71

Elemental Analysis: C, 67.73; H, 5.85; N, 13.54; O, 12.89

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

HTL0029881

IUPAC/Chemical Name

(17R,25aR,E)-15-methyl-17-((7-methyl-1H-indazol-5-yl)methyl)-10,11,14,15,17,18-hexahydro-8H,13H,25H-3,5-(azenometheno)-23,25a-methano-20,24-(metheno)pyrrolo[3,4-r][1,4]dioxa[7,10]diazacyclotetracosine-1,16,19(2H)-trione

InChi Key

LJMGRDULDLZQAJ-ATKWODBQSA-N

InChi Code

InChI=1S/C35H36N6O5/c1-21-12-23(13-27-20-37-40-30(21)27)15-29-33(43)41(2)7-9-46-11-10-45-8-3-4-22-14-28-31(36-19-22)39-34(44)35(28)17-25-6-5-24(32(42)38-29)16-26(25)18-35/h3-6,12-14,16,19-20,29H,7-11,15,17-18H2,1-2H3,(H,37,40)(H,38,42)(H,36,39,44)/b4-3+/t29-,35-/m1/s1

SMILES Code

CC1=CC(C[C@H]2NC(C3=CC4=C(C=C3)C[C@@]5(C4)C6=C(NC5=O)N=CC(/C=C/COCCOCCN(C)C2=O)=C6)=O)=CC7=C1NN=C7

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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 620.71 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

1. Southall SM, Banerjee J, Brown J, Butkovic K, Cansfield AD, Cansfield JE, Congreve MS, Cseke G, Deflorian F, Hunjadi MP, Hutinec A, Inturi TK, Rupcic R, Saxty G, Watson SP. Novel Macrocyclic Antagonists of the CGRP Receptor Part 2: Stereochemical Inversion Induces an Unprecedented Binding Mode. ACS Med Chem Lett. 2022 Oct 19;13(11):1776-1782. doi: 10.1021/acsmedchemlett.2c00400. PMID: 36385934; PMCID: PMC9661699.