E852-0385 Screening compound: N6-cyclohexyl-5,6-dimethyl-N2-(4-methylcyclohexyl)-4-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
Chemical Structure Depiction of ChemDiv screening compound E852-0385
N6-cyclohexyl-5,6-dimethyl-N2-(4-methylcyclohexyl)-4-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
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
E852-0385
Molecular Formula
C23H35N5O3 (C23 H35 N5 O3)
Compound Name
N6-cyclohexyl-5,6-dimethyl-N2-(4-methylcyclohexyl)-4-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazine-2,6-dicarboxamide
IUPAC name
N6-cyclohexyl-56-dimethyl-N2-(4-methylcyclohexyl)-4-oxo-4H5H6H7H-pyrazolo[15-a]pyrazine-26-dicarboxamide
SMILES
CC(CC1)CCC1NC(c1nn(CC(C)(C(NC2CCCCC2)=O)N(C)C2=O)c2c1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
429.56
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
3.428
Distribution Coefficient, logD
3.428
Water Solubility, LogSw
-3.66
Polar Surface Area
77.646
Acid Dissociation Constant (pKa)
13.93
Base Dissociation Constant (pKb)
3.24
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
73.90
E852-0385 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
3D-Pharmacophore Based Diversity Library (49813 compounds)
Autophagy-Targeted Library (4564 compounds)
Cyclic Ugi PPI Library (9586 compounds)
PPI Inhibitors Tripeptide Mimetics (23972 compounds)
Protein-Protein Interaction Library (218420 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- 3D
- Cyclic compounds
- Mimetics
- Mimetics
- Infections
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- PPI modulators
- PPI modulators
- PPI modulators
- PPI modulators
References: we are preparing a list of scientific research reports with E852-0385 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)