BA-53038B| CAS#N/A| allosteric modulator| MedKoo

MedKoo Cat#: 565502 | Name: BA-53038B

Description:

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

BA-53038B is Hepatitis B Virus Nucleocapsid Assembly Inhibitor. Drug resistant profile analyses indicated that BA-53038B most likely bound to the HAP pocket but obviously modulated HBV capsid assembly in a distinct manner.

Chemical Structure

BA-53038B

CAS#N/A

Theoretical Analysis

MedKoo Cat#: 565502

Name: BA-53038B

CAS#: N/A

Chemical Formula: C14H16ClNO

Exact Mass: 249.0920

Molecular Weight: 249.74

Elemental Analysis: C, 67.33; H, 6.46; Cl, 14.19; N, 5.61; O, 6.41

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

BA-53038B; BA 53038B; BA53038B

IUPAC/Chemical Name

(1R,6S,7r)-N-(3-Chlorophenyl)bicyclo[4.1.0]heptane-7-carboxamide

InChi Key

ZLCICHYECNOTGG-ITGUQSILSA-N

InChi Code

InChI=1S/C14H16ClNO/c15-9-4-3-5-10(8-9)16-14(17)13-11-6-1-2-7-12(11)13/h3-5,8,11-13H,1-2,6-7H2,(H,16,17)/t11-,12+,13+

SMILES Code

O=C([C@@H]1[C@@]2([H])CCCC[C@@]12[H])NC3=CC=CC(Cl)=C3

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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 249.74 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: Zhang X, Cheng J, Ma J, Hu Z, Wu S, Hwang N, Kulp J, Du Y, Guo JT, Chang J. Discovery of Novel Hepatitis B Virus Nucleocapsid Assembly Inhibitors. ACS Infect Dis. 2019 May 10;5(5):759-768. doi: 10.1021/acsinfecdis.8b00269. Epub 2018 Dec 19. PubMed PMID: 30525438; PubMed Central PMCID: PMC6510629.