E981-0640 Screening compound: N-(4-chlorophenyl)-3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound E981-0640
N-(4-chlorophenyl)-3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4-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
E981-0640
Molecular Formula
C21H17ClN4O (C21 H17 ClN4 O)
Compound Name
N-(4-chlorophenyl)-3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
IUPAC name
N-(4-chlorophenyl)-36-dimethyl-1-phenyl-1H-pyrazolo[34-b]pyridine-4-carboxamide
SMILES
Cc(c(c1nc(C)c2)c2C(Nc(cc2)ccc2Cl)=O)nn1-c1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
376.85
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.367
Distribution Coefficient, logD
4.361
Water Solubility, LogSw
-4.63
Polar Surface Area
46.532
Acid Dissociation Constant (pKa)
9.29
Base Dissociation Constant (pKb)
1.01
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
9.50
E981-0640 in Drug Discovery
Included in Screening Libraries
Antiviral Annotated Library (21441 compounds)
Protein-Protein Interaction Library (218420 compounds)
Selective Target Activity Profiling Library (14702 compounds)
Therapeutical Diversity Annotated Library (7563 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- PPI modulators
References: we are preparing a list of scientific research reports with E981-0640 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)