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CAS No.: | 149950-60-7 |
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Name: | emivirine |
Article Data: | 10 |
Molecular Structure: | |
Formula: | C17H22 N2 O3 |
Molecular Weight: | 302.373 |
Synonyms: | 1-(Ethoxymethyl)-6-benzyl-5-isopropyluracil;Coactinon; Emivirine; I-EBU; MKC 442 |
Density: | 1.133g/cm3 |
Boiling Point: | °Cat760mmHg |
Flash Point: | °C |
Hazard Symbols: | Moderately toxic by ingestion. |
Safety: | Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx. |
PSA: | 64.09000 |
LogP: | 2.24480 |
Empirical Formula of Emivirine (CAS NO.149950-60-7): C17H22N2O3
Molecular Weight: 302.3682 g/mol
Index of Refraction: 1.542
Density: 1.133 g/cm3
Structure of Emivirine (CAS NO.149950-60-7):
IUPAC Name: 6-Benzyl-1-(ethoxymethyl)-5-propan-2-ylpyrimidine-2,4-dione
Canonical SMILES: CCOCN1C(=C(C(=O)NC1=O)C(C)C)CC2=CC=CC=C2
InChI: InChI=1S/C17H22N2O3/c1-4-22-11-19-14(10-13-8-6-5-7-9-13)15(12(2)3)16(20)18-17(19)21/h5-9,12H,4,10-11H2,1-3H3,(H,18,20,21)
InChIKey: MLILORUFDVLTSP-UHFFFAOYSA-N
Emivirine (CAS NO.149950-60-7) has been used for the treatment of HIV as a failed experimental agent.
1. | orl-rat LDLo:2500 mg/kg | AMACCQ Antimicrobial Agents and Chemotherapy. 44 (2000),123. |
Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx.
Emivirine ,its cas register number is 149950-60-7. It also can be called MKC 442 ; and 6-Benzyl-1-(ethoxymethyl)-5-isopropylpyrimidine-2,4(1H,3H)-dione . It is a non-nucleoside reverse transcriptase inhibitor.