HIV-1 Integrase Inhibitor

Base Information

• Chemical Name: HIV-1 Integrase Inhibitor
• CAS No.: 544467-07-4
• Molecular Formula: C11H9N3O4
• Molecular Weight: 247.20700
• NSC Number: 742545
• ChEMBL ID: CHEMBL564495
• Mol file: 544467-07-4.mol

Synonyms:HIV-1 Integrase Inhibitor;CHEMBL564495;2-Hydroxy-4-(3-azidomethylphenyl)-4-oxo-2-butenoic acid;SCHEMBL14730075;2-Butenoic acid, 4-[3-(azidomethyl)phenyl]-2-hydroxy-4-oxo;BDBM50480814;AKOS040733382;CS-0461;NSC-742545;HY-13025

Chemical Property of HIV-1 Integrase Inhibitor

Chemical Property:

• PSA: 124.35000
• LogP: 1.65886
• Solubility.: Soluble in DMSO
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 247.05930578
• Heavy Atom Count: 18
• Complexity: 413

Purity/Quality:

99%min ^*data from raw suppliers

HIV-1integraseinhibitor >98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)C(=CC(=O)C(=O)O)O)CN=[N+]=[N-]
• Isomeric SMILES: C1=CC(=CC(=C1)/C(=C/C(=O)C(=O)O)/O)CN=[N+]=[N-]