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Details

Stereochemistry ACHIRAL
Molecular Formula C20H24N2O3
Molecular Weight 340.4162
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IQP-0528

SMILES

CC(C)C1=C(N(CC2CC2)C(=O)NC1=O)C(=O)C3=CC(C)=CC(C)=C3

InChI

InChIKey=UCOAKFIVSAVHLC-UHFFFAOYSA-N
InChI=1S/C20H24N2O3/c1-11(2)16-17(18(23)15-8-12(3)7-13(4)9-15)22(10-14-5-6-14)20(25)21-19(16)24/h7-9,11,14H,5-6,10H2,1-4H3,(H,21,24,25)

HIDE SMILES / InChI

Molecular Formula C20H24N2O3
Molecular Weight 340.4162
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

IQP-0528 is an antiretroviral pyrimidinedione derivative with activity against human immunodeficiency virus (HIV) in the nanomolar range. It is a non-nucleoside reverse transcriptase inhibitor that also inhibits HIV entry through an unknown mechanism thought to target a conformational epitope formed prior to the fusion of the viral envelope with the host cellular membrane. IQP-0528 is under clinical development for HIV prevention.

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents

Patents

Sample Use Guides

IQP-0528 (SJ-3366) exhibited a Ki value of 3.2 nM, with a mixed mechanism of inhibition against human immunodeficiency virus type 1 (HIV-1) reverse transcriptase, but it did not inhibit HIV-2 reverse transcriptase. SJ-3366 also inhibited the entry of both HIV-1 and HIV-2 into target cells.
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:02:45 UTC 2023
Edited
by admin
on Sat Dec 16 08:02:45 UTC 2023
Record UNII
1Y42TZL33O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IQP-0528
Common Name English
IQP-528
Code English
2,4(1H,3H)-PYRIMIDINEDIONE, 1-(CYCLOPROPYLMETHYL)-6-(3,5-DIMETHYLBENZOYL)-5-(1-METHYLETHYL)-
Systematic Name English
Code System Code Type Description
CAS
1367755-87-0
Created by admin on Sat Dec 16 08:02:45 UTC 2023 , Edited by admin on Sat Dec 16 08:02:45 UTC 2023
SUPERSEDED
FDA UNII
1Y42TZL33O
Created by admin on Sat Dec 16 08:02:45 UTC 2023 , Edited by admin on Sat Dec 16 08:02:45 UTC 2023
PRIMARY
PUBCHEM
483499
Created by admin on Sat Dec 16 08:02:45 UTC 2023 , Edited by admin on Sat Dec 16 08:02:45 UTC 2023
PRIMARY
DRUG BANK
DB14888
Created by admin on Sat Dec 16 08:02:45 UTC 2023 , Edited by admin on Sat Dec 16 08:02:45 UTC 2023
PRIMARY
CAS
301297-45-0
Created by admin on Sat Dec 16 08:02:45 UTC 2023 , Edited by admin on Sat Dec 16 08:02:45 UTC 2023
PRIMARY
Related Record Type Details
TARGET ORGANISM->INHIBITOR
EC50
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY