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Peramivir

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Name

Peramivir

EINECS N/A
CAS No. 330600-85-6 Density 1.39 g/cm3
PSA 151.03000 LogP 1.44240
Solubility N/A Melting Point N/A
Formula C15H28N4O4 Boiling Point N/A
Molecular Weight 328.40722 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 330600-85-6 ((1S,2R,3R,4R)-3-(1-acetamido-2-ethyl-butyl)-4-(diaminomethylideneamino)-2-hydroxy-cyclopentane-1-carboxylic acid) Hazard Symbols N/A
Synonyms

3-(1'-acetylamino-2'-ethyl)butyl-4-((aminoimino)methyl)amino-2-hydroxycyclopentane-1-carboxylic acid;

 

Peramivir Specification

1. Introduction of Peramivir
Peramivir is a new antiviral agent for influenza treatment. The IUPAC name of this chemical is called (1S,2S,3S,4R)-3-[(1S)-1-acetamido-2-ethylbutyl]-4-(diaminomethylideneamino)-2-hydroxycyclopentane-1-carboxylic acid. Peramivir belongs to Amines; Chiral Reagents; Intermediates & Fine Chemicals; Pharmaceuticals. This chemical's classification codes are Influenza Treatment; Neuroaminidase inhibitor; Treatment and prevention of influenza A and B viruses. It which is also known as Cyclopentanecarboxylic acid, 3-((1S)-1-(acetylamino)-2-ethylbutyl)-4-((aminoiminomethyl)amino)-2-hydroxy-, (1S,2S,3R,4R)- can freely soluble in water.

2. Properties of Peramivir
Physical properties about Peramivir are:
(1)ACD/LogP: -0.87; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -3.35; (4)ACD/LogD (pH 7.4): -3.37; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 8; (10)#H bond donors: 7; (11)#Freely Rotating Bonds: 8; (12)Index of Refraction: 1.613; (13)Molar Refractivity: 81.91 cm3; (14)Molar Volume: 235 cm3; (15)Surface Tension: 52.4 dyne/cm; (16)Density: 1.39 g/cm3.

3. Structure Descriptors of Peramivir
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCC(CC)C(C1C(CC(C1O)C(=O)O)N=C(N)N)NC(=O)C
(2)Isomeric SMILES: CCC(CC)[C@@H]([C@H]1[C@@H](C[C@@H]([C@H]1O)C(=O)O)N=C(N)N)NC(=O)C
(3)InChI: InChI=1S/C15H28N4O4/c1-4-8(5-2)12(18-7(3)20)11-10(19-15(16)17)6-9(13(11)21)14(22)23/h8-13,21H,4-6H2,1-3H3,(H,18,20)(H,22,23)(H4,16,17,19)/t9-,10+,11+,12-,13+/m0/s1
(4)InChIKey: XRQDFNLINLXZLB-CKIKVBCHSA-N
(5)Smiles: C1[C@H]([C@@H]([C@@H]([C@H]1C(=O)O)O)[C@H](C(CC)CC)NC(=O)C)NC(=N)N

4. Uses of Peramivir
Peramivir is an experimental antiviral drug developed by BioCryst Pharmaceuticals for the treatment of influenza. Peramivir is a neuraminidase inhibitor, acting as a transition-state analogue inhibitor of influenza neuraminidase and thereby preventing new viruses from emerging from infected cells. In October 2009, it was reported that the experimental antiviral drug peramivir had been effective in treating serious cases of swine flu. On October 23, the U.S. Food and Drug Administration (FDA) issued an Emergency Use Authorization for Peramivir, allowing the use of the drug in intravenous form for hospitalized patients only in cases where the other available methods of treatment are ineffective or unavailable; for instance, if oseltamivir (Tamiflu) resistance develops and a person is unable to take Relenza via the inhaled route. Peramivir is currently the only intravenous option for treating swine flu.

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