Emivirine

Modify Date: 2024-01-01 22:32:29

Emivirine Structure
Emivirine structure
Common Name Emivirine
CAS Number 149950-60-7 Molecular Weight 302.37
Density N/A Boiling Point N/A
Molecular Formula C17H22N2O3 Melting Point N/A
MSDS N/A Flash Point N/A

 Use of Emivirine


Emivirine (MKC-442) is a non-nucleoside reverse transcriptase inhibitors (NNRTIs) with Ki values of 0.20 and 0.01 μM for dTTP- and dGTP-dependent DNA or RNA polymerase activity, respectively. Emivirine displays potent and selective anti-human immunodeficiency virus type 1 (HIV-1) activity[1][2].

 Names

Name emivirine
Synonym More Synonyms

 Emivirine Biological Activity

Description Emivirine (MKC-442) is a non-nucleoside reverse transcriptase inhibitors (NNRTIs) with Ki values of 0.20 and 0.01 μM for dTTP- and dGTP-dependent DNA or RNA polymerase activity, respectively. Emivirine displays potent and selective anti-human immunodeficiency virus type 1 (HIV-1) activity[1][2].
Related Catalog
In Vitro Emivirine (EMV) is also specific for HIV-1 RT and was without effect on HIV-2[2]. Emivirine (EMV) has no obvious toxicity for human healthy cells[2]. Cell Viability Assay[2] Cell Line: Human bone marrow cells collected from normal healthy volunteers. Concentration: 0, 0.1, 1, 10, or 100 μM. Incubation Time: 14 days. Result: At concentrations of 0.1 to 10 μM, no effect on cell growth, lactic acid production, mitochondrial DNA synthesis, or mitochondrial structure was seen compared to what occurred with untreated HepG2 cells.
In Vivo Tthe approximate lethal oral dose of Emivirine (EMV) for rats was ≥3 g/kg for males and 2.5 g/kg for females[2]. Animal Model: Male Sprague-Dawley rats[2]. Dosage: 50 mg/kg. Administration: Gavage. Result: The oral absorption was 68%.
References

[1]. Panita Decha, et al. Theoretical studies on the molecular basis of HIV-1RT/NNRTIs interactions. J Enzyme Inhib Med Chem. 2011 Feb;26(1):29-36.

[2]. G M Szczech, et al. Safety assessment, in vitro and in vivo, and pharmacokinetics of emivirine, a potent and selective nonnucleoside reverse transcriptase inhibitor of human immunodeficiency virus type 1. Antimicrob Agents Chemother. 2000 Jan;44(1):123-30.

 Chemical & Physical Properties

Molecular Formula C17H22N2O3
Molecular Weight 302.37
Exact Mass 302.16300
PSA 64.09000
LogP 2.24480

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UV9088750
CHEMICAL NAME :
2,4(1H,3H)-Pyrimidinedione, 1-(ethoxymethyl)-5-(1-methylethyl)-6-(phenylmethyl)-
CAS REGISTRY NUMBER :
149950-60-7
LAST UPDATED :
199603
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H22-N2-O3
MOLECULAR WEIGHT :
302.41

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 38,2860,1995

 Safety Information

HS Code 2933990090

 Synthetic Route

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

I-EBU
1EtOMe6Bz5i-Pr-U
Emivirine
Emivirine [USAN:INN]
[14C]-Emivirine
1-(ethoxymethyl)-5-(1-methylethyl)-6-(phenylmethyl)pyrimidine-2,4(1H,3H)-dione
Coactinon
Mkc 442
1-ethoxymethyl-5-isopropyl-6-benzyluracil
6-benzyl-1-(ethoxymethyl)-5-isopropyl uracil
6-benzyl-1-(ethoxymethyl)-5-propan-2-ylpyrimidine-2,4-dione
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