WARNING: This product is for research use only, not for human or veterinary use.
Hodoodo CAT#: H341404
CAS#: 156586-91-3
Description: Xemilofiban hydrochloride is a biochemical.
Hodoodo Cat#: H341404
Name: Xemilofiban hydrochloride
CAS#: 156586-91-3
Chemical Formula: C18H23ClN4O4
Exact Mass: 394.14
Molecular Weight: 394.856
Elemental Analysis: C, 54.75; H, 5.87; Cl, 8.98; N, 14.19; O, 16.21
This product is not in stock, which may be available by custom synthesis.
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Synonym: Xemilofiban hydrochloride; SC-54684A; SC 54684A; SC54684A.
IUPAC/Chemical Name: Pentynoic acid, 3-((4-((4-(aminoiminomethyl)phenyl)amino)-1,4-dioxobutyl)amino)-, ethyl ester, monohydrochloride, (S)-
InChi Key: JTZJXWLQRZUDFJ-BTQNPOSSSA-N
InChi Code: InChI=1S/C18H22N4O4.ClH/c1-3-13(11-17(25)26-4-2)21-15(23)9-10-16(24)22-14-7-5-12(6-8-14)18(19)20;/h1,5-8,13H,4,9-11H2,2H3,(H3,19,20)(H,21,23)(H,22,24);1H/t13-;/m1./s1
SMILES Code: C#C[C@@H](NC(CCC(NC1=CC=C(C(N)=N)C=C1)=O)=O)CC(OCC)=O.[H]Cl
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: >2 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:
Biological target: | |
In vitro activity: | |
In vivo activity: |
The following data is based on the product molecular weight 394.86 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 |
Formulation protocol: | |
In vitro protocol: | |
In vivo protocol: |
1: Bhatt DL, Topol EJ. Current role of platelet glycoprotein IIb/IIIa inhibitors in acute coronary syndromes. JAMA. 2000 Sep 27;284(12):1549-58. Review. PubMed PMID: 11000650.
2: Topgi RS, Ng JS, Landis B, Wang P, Behling JR. Use of enzyme penicillin acylase in selective amidation/amide hydrolysis to resolve ethyl 3-amino-4-pentynoate isomers. Bioorg Med Chem. 1999 Oct;7(10):2221-9. PubMed PMID: 10579530.