E852-0520 Screening compound: N-cyclohexyl-5,6-dimethyl-4-oxo-2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
Chemical Structure Depiction of ChemDiv screening compound E852-0520
N-cyclohexyl-5,6-dimethyl-4-oxo-2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
E852-0520
Molecular Formula
C24H32N8O3 (C24 H32 N8 O3)
Compound Name
N-cyclohexyl-5,6-dimethyl-4-oxo-2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
IUPAC name
N-cyclohexyl-56-dimethyl-4-oxo-2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-4H5H6H7H-pyrazolo[15-a]pyrazine-6-carboxamide
SMILES
CC(Cn(c1c2)nc2C(N(CC2)CCN2c2ncccn2)=O)(C(NC2CCCCC2)=O)N(C)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
480.57
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
11
Partition Coefficient, logP
1.647
Distribution Coefficient, logD
1.647
Water Solubility, LogSw
-2.11
Polar Surface Area
91.778
Acid Dissociation Constant (pKa)
14.81
Base Dissociation Constant (pKb)
2.67
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
58.30
E852-0520 in Drug Discovery
Included in Screening Libraries
Cyclic Ugi PPI Library (9586 compounds)
PPI Inhibitors Tripeptide Mimetics (23972 compounds)
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
- Cyclic compounds
- Mimetics
- Mimetics
References: we are preparing a list of scientific research reports with E852-0520 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)