E856-2905 Screening compound: 4-{[2-(3-chlorophenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}-N-(3,4-dimethoxyphenyl)benzamide
Chemical Structure Depiction of ChemDiv screening compound E856-2905
4-{[2-(3-chlorophenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}-N-(3,4-dimethoxyphenyl)benzamide
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
E856-2905
Molecular Formula
C28H25ClN4O4 (C28 H25 ClN4 O4)
Compound Name
4-{[2-(3-chlorophenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}-N-(3,4-dimethoxyphenyl)benzamide
IUPAC name
4-{[2-(3-chlorophenyl)-5-oxo-4H5H6H7H-pyrazolo[15-a]pyrimidin-4-yl]methyl}-N-(34-dimethoxyphenyl)benzamide
SMILES
COc(ccc(NC(c1ccc(CN(c2cc(-c3cccc(Cl)c3)nn2CC2)C2=O)cc1)=O)c1)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
516.98
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
4.828
Distribution Coefficient, logD
4.826
Water Solubility, LogSw
-4.82
Polar Surface Area
66.373
Acid Dissociation Constant (pKa)
9.81
Base Dissociation Constant (pKb)
-1.22
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
17.90
E856-2905 in Drug Discovery
Included in Screening Libraries
Nonpeptide Peptidomimetics PPI Library (18997 compounds)
Protein-Protein Interaction Library (218420 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Mimetics
References: we are preparing a list of scientific research reports with E856-2905 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of E856-2905, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
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)