MedKoo Cat#: 126935 | Name: SH442

Description:

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

SH-442 is a potent antiosteoporosis agent with IC50 = 0.052 μM). SH442 exhibited100% inhibition at 1.0 μM and 82.8% inhibition at an even lower concentration of 0.1 μM, which was much more potent than the lead compound bisnoralcohol (BA) (IC50 = 2.325 μM). Cytotoxicity tests suggested that the inhibitory effect of these compounds on RANKL-induced osteoclast differentiation did not result from their cytotoxicity. Mechanistic studies revealed that SH442 inhibited the expression of osteoclastogenesis-related marker genes and proteins, including TRAP, TRAF6, c-Fos, CTSK, and MMP9. Especially, SH442 could significantly attenuate bone loss of ovariectomy mouse in vivo.

Chemical Structure

SH442
SH442
CAS#N/A

Theoretical Analysis

MedKoo Cat#: 126935

Name: SH442

CAS#: N/A

Chemical Formula: C26H39N3OS

Exact Mass: 441.2814

Molecular Weight: 441.68

Elemental Analysis: C, 70.70; H, 8.90; N, 9.51; O, 3.62; S, 7.26

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.
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Related CAS #
No Data
Synonym
SH442; SH-442; SH 442
IUPAC/Chemical Name
(S)-N-ethyl-2-((1R,3aS,3bS,10aR,10bS,12aS)-6,6,10a,12a-tetramethyl-2,3,3a,3b,4,6,10,10a,10b,11,12,12a-dodecahydro-1H-cyclopenta[7,8]phenanthro[2,3-d][1,2,3]thiadiazol-1-yl)propanamide
InChi Key
NLCGICDIPSNKML-CPALLIIRSA-N
InChi Code
InChI=1S/C26H39N3OS/c1-7-27-23(30)15(2)17-9-10-18-16-8-11-21-24(3,4)22-20(31-29-28-22)14-26(21,6)19(16)12-13-25(17,18)5/h11,15-19H,7-10,12-14H2,1-6H3,(H,27,30)/t15-,16-,17+,18-,19-,25+,26+/m0/s1
SMILES Code
O=C(NCC)[C@@H](C)[C@H]1CC[C@@]2([H])[C@]([C@]3([H])CC[C@@]21C)([H])CC=C([C@]3(C)C4)C(C)(C)C5=C4SN=N5
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

Preparing Stock Solutions

The following data is based on the product molecular weight 441.68 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
Zhang DJ, Chen R, Zhang YX, Li CC, Ning RN, Jiang M, Qiu WW. Synthesis of Heterocyclic Ring-Fused Bisnoralcohol Derivatives as Novel Small-Molecule Antiosteoporosis Agents. J Med Chem. 2024 May 8. doi: 10.1021/acs.jmedchem.4c00349. Epub ahead of print. PMID: 38717088.