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619331-12-3

619331-12-3 Structure

619331-12-3 Structure
IdentificationBack Directory
[Name]

BMS-585248
[CAS]

619331-12-3
[Synonyms]

BMS-585248
CIO2TZZ9H1
CHEMBL236995
UNII-CIO2TZZ9H1
1-(4-benzoylpiperazin-1-yl)-2-[4-fluoro-7-(triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl]ethane-1,2-dione
1,2-Ethanedione, 1-(4-benzoyl-1-piperazinyl)-2-[4-fluoro-7-(1H-1,2,3-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-
[Molecular Formula]

C22H18FN7O3
[MDL Number]

MFCD28386230
[MOL File]

619331-12-3.mol
[Molecular Weight]

447.42
Chemical PropertiesBack Directory
[Boiling point ]

733.0±70.0 °C(Predicted)
[density ]

1.54±0.1 g/cm3(Predicted)
[pka]

10.08±0.40(Predicted)
Hazard InformationBack Directory
[Uses]

BMS-585248 is a potent, third-generation HIV-1 attachment inhibitor with a promising initial in vitro and in vivo pharmacokinetic profile[1].
[in vivo]

BMS-585248 (intravenous (1 mg/kg) and oral (5-200 mg/kg); once) has a good pharmacokinetic profile, with AUC values of 3220 nM·h and 8064 nM·h after IV (1 mg/kg) and oral (5 mg/kg) administration in male rats, respectively[1].

Animal Model:Male rats[1]
Dosage:5, 15, and 200 mg/kg
Administration:Orally, once (Pharmacokinetic Analysis)
Result:Pharmacokinetic Parameters of BMS-585248 in male rats[1].
PO
Dose (mg/kg)1575200
Cmax (μM)6.68.411
AUCtot (μM·h)42115145
[IC 50]

HIV-1
[References]

[1] Regueiro-Ren A, et al. Inhibitors of human immunodeficiency virus type 1 (HIV-1) attachment 13. Synthesis and profiling of a novel amminium prodrug of the HIV-1 attachment inhibitor BMS-585248. J Med Chem. 2013 Feb 28;56(4):1670-6. DOI:10.1021/jm301638a
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