WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 463205
Description: E-2101 is a novel antispastic drug.
MedKoo Cat#: 463205
Chemical Formula: C24H28FN3O
Exact Mass: 393.2216
Molecular Weight: 393.5064
Elemental Analysis: C, 73.26; H, 7.17; F, 4.83; N, 10.68; O, 4.07
This product is not in stock, which may be available by custom synthesis.
For cost-effective reason, minimum order is 1g (price is usually high, lead time is 2~3 months, depending on the technical challenge).
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Synonym: E-2101; E2101; E 2101;
IUPAC/Chemical Name: 2-(1-(1-(2-fluorophenethyl)piperidin-4-yl)-1H-indol-6-yl)-N-methylacetamide
InChi Key: CQEOXWCXSBFJMB-UHFFFAOYSA-N
InChi Code: InChI=1S/C24H28FN3O/c1-26-24(29)17-18-6-7-20-9-15-28(23(20)16-18)21-10-13-27(14-11-21)12-8-19-4-2-3-5-22(19)25/h2-7,9,15-16,21H,8,10-14,17H2,1H3,(H,26,29)
SMILES Code: CNC(Cc(cc1)cc2c1ccn2C3CCN(CC3)CCc4c(F)cccc4)=O
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
The following data is based on the product molecular weight 393.5064 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: Kushida I, Ashizawa K. Solid state characterization of E2101, a novel antispastic drug. J Pharm Sci. 2002 Oct;91(10):2193-202. doi: 10.1002/jps.10211. PMID: 12226846.
2: Zhang ZY, King BM, Mollova NN, Wong YN. In vitro interactions between a potential muscle relaxant E2101 and human cytochromes P450. Drug Metab Dispos. 2002 Jul;30(7):805-13. doi: 10.1124/dmd.30.7.805. PMID: 12065439.