CAS 1568-80-5|HIV-1 integrase inhibitor 8

Introduction:Basic information about CAS 1568-80-5|HIV-1 integrase inhibitor 8, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameHIV-1 integrase inhibitor 8
CAS Number1568-80-5Molecular Weight308.41400
Density1.21±0.1 g/cm3(Predicted)Boiling Point478.5℃ at 760 mmHg
Molecular FormulaC21H24O2Melting Point213-214 °C
MSDSUSAFlash Point220.4℃

Names

Name2,2',3,3'-tetrahydro-3,3,3',3'-tetramethyl-1,1'-Spirobi(1H-indene)-6,6'-diol
SynonymMore Synonyms

HIV-1 integrase inhibitor 8 BiologicalActivity

DescriptionHIV-1 integrase inhibitor 8 is a HIV-1 integrase inhibitor, compound 8[1].
Related CatalogResearch Areas >>InfectionSignaling Pathways >>Metabolic Enzyme/Protease >>HIV Integrase
In VitroHIV-1 integrase inhibitor 8 is against 3′-processing (TC) and strand-transfer (ST) activities in the presence of Mn2+ as the cationic cofactor by gel assay with IC50 values of 275 µM and 200 µM, respectively. It inhibits the strand-transfer (ST) activity with an IC50 value of 200 µM[1]. The DNA relaxation activity of MCV topoisomerase is monitored by gel electrophoresis, while DNA cleavage and religation activities were monitored using a microtiter assay. HIV-1 integrase inhibitor 8 inhibits MCV topoisomerase and DNA religation with IC50 values of 500 µM and 200 µM, respectively. This result demonstrates that compound 8 is inactive against topoisomerase in both assays[1]. HIV-1 integrase inhibitor 8 induces cell cytotoxicity and yields a LD50 (dose at which the signal is reduced 50% due to cell death) of 20 μM in HeLa cells[1].
References

[1]. Molteni, et al. A New Class of HIV-1 Integrase Inhibitors: The 3,3,3', 3'-tetramethyl-1,1'-spirobi(indan)-5,5',6,6'-tetrol Family.J Med Chem

Chemical & Physical Properties

Density1.21±0.1 g/cm3(Predicted)
Boiling Point478.5℃ at 760 mmHg
Melting Point213-214 °C
Molecular FormulaC21H24O2
Molecular Weight308.41400
Flash Point220.4℃
Exact Mass308.17800
PSA40.46000
LogP4.74650
Vapour Pressure8.84E-10mmHg at 25°C
InChIKeySICLLPHPVFCNTJ-UHFFFAOYSA-N
SMILESCC1(C)CC2(CC(C)(C)c3ccc(O)cc32)c2cc(O)ccc21

Safety Information

HS Code2906299090

Customs

HS Code2906299090
Summary2906299090 other aromatic alcohols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

Synonyms

2,2',3,3'-Tetrahydro-3,3,3',3'-tetramethyl-1,1'-spirobi<1H-indene>-6,6'-diol
6,6'-dihydroxy-3,3,3',3'-tetramethyl-1,1'-spirobisindane
(2,2,3,3-tetrafluoropropoxy)acetic acid
6,6'-dihydroxy-3,3,3',3'-tetramethyl-1,1'-spirobiindane
2,2,3,3-Tetrafluor-propyloxy-essigsaeure
3,3,3',3'-tetramethyl-1,1'-spirobisindane-6,6'-diol
6,6'-dihydroxy-3,3,3',3'-tetramethyl-1,1'-spirobiindan
SPIROBIINDANE
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