Batefenterol Succinate

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

MedKoo CAT#: 565052

CAS#: 945905-37-3

Description: Batefenterol Succinate is a first-in-class inhaled bifunctional bronchodilator possessing muscarinic receptor antagonist and β2-adrenoceptor agonist properties.


Price and Availability

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Batefenterol Succinate is not in stock, may be available through custom synthesis. For cost-effective reason, minimum 1 gram order is requested. The product will be characterized by NMR, HPLC and MS analysis. Purity (HPLC) is usually >98%. CoA, QC data, MSDS will be provided when product is successfully made. The estimated lead time is 2-3 months. Please send email to sales@medkoo.com to inquire quote.


Chemical Structure

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Theoretical Analysis

MedKoo Cat#: 565052
Name: Batefenterol Succinate
CAS#: 945905-37-3
Chemical Formula: C44H48ClN5O11
Exact Mass: 857.3039
Molecular Weight: 858.34
Elemental Analysis: C, 61.57; H, 5.64; Cl, 4.13; N, 8.16; O, 20.50


Synonym: GSK-961081D; TD5959; TD 5959; TD-5959; MABA; Batefenterol succinate

IUPAC/Chemical Name: (R)-1-(3-((2-chloro-4-(((2-hydroxy-2-(8-hydroxy-2-oxo-1,2-dihydroquinolin-5-yl)ethyl)amino)methyl)-5-methoxyphenyl)amino)-3-oxopropyl)piperidin-4-yl [1,1'-biphenyl]-2-ylcarbamate succinate

InChi Key: BDWHLFQPZLPCIZ-XLQCLRHOSA-N

InChi Code: InChI=1S/C40H42ClN5O7.C4H6O4/c1-52-36-22-33(31(41)21-26(36)23-42-24-35(48)29-11-13-34(47)39-30(29)12-14-37(49)45-39)43-38(50)17-20-46-18-15-27(16-19-46)53-40(51)44-32-10-6-5-9-28(32)25-7-3-2-4-8-25;5-3(6)1-2-4(7)8/h2-14,21-22,27,35,42,47-48H,15-20,23-24H2,1H3,(H,43,50)(H,44,51)(H,45,49);1-2H2,(H,5,6)(H,7,8)/t35-;/m0./s1

SMILES Code: O=C(O)CCC(O)=O.O=C(NC1=CC(OC)=C(CNC[C@H](O)C2=CC=C(O)C3=C2C=CC(N3)=O)C=C1Cl)CCN4CCC(OC(NC5=C(C6=CC=CC=C6)C=CC=C5)=O)CC4


Technical Data

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).

Harmonized System Code:
2934990300