Trovirdine

Base Information

• Chemical Name: Trovirdine
• CAS No.: 149488-17-5
• Molecular Formula: C13H13 Br N4 S
• Molecular Weight: 337.24
• UNII: ZE3K6J8614
• DSSTox Substance ID: DTXSID00869977
• Nikkaji Number: J649.058A
• Wikidata: Q27295380
• NCI Thesaurus Code: C76931
• ChEMBL ID: CHEMBL39999
• Mol file: 149488-17-5.mol

Synonyms:LY 300046;LY-300046;LY300046.HCl;N-(2-(2-pyridyl)ethyl)-N'-(2-(5-bromo)pyridyl)thiourea hydrochloride;trovirdine

Chemical Property of Trovirdine

Chemical Property:

• Vapor Pressure: 2.61E-08mmHg at 25°C
• Boiling Point: 450.6°Cat760mmHg
• PKA: 11.14±0.70(Predicted)
• Flash Point: 226.3°C
• PSA: 81.93000
• Density: 1.539g/cm³
• LogP: 3.23210
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 336.00443
• Heavy Atom Count: 19
• Complexity: 290

Purity/Quality:

98%Min ^*data from raw suppliers

Trovirdine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=NC(=C1)CCNC(=S)NC2=NC=C(C=C2)Br
• Uses: Trovirdine inhibits HIV-1 RT with an IC50 of 7 nM when employing heteropolymeric primer/template (oligo-DNA/ribosomal RNA)and dGTP as substrate.