E856-3150 Screening compound: methyl 2-(4-{[2-(4-chlorophenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}benzamido)benzoate

E856-3150 Screening compound: methyl 2-(4-{[2-(4-chlorophenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}benzamido)benzoate
E856-3150 Screening compound: methyl 2-(4-{[2-(4-chlorophenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}benzamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound E856-3150
methyl 2-(4-{[2-(4-chlorophenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}benzamido)benzoate

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

E856-3150

Molecular Formula

C28H23ClN4O4 (C28 H23 ClN4 O4)

Compound Name

methyl 2-(4-{[2-(4-chlorophenyl)-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl]methyl}benzamido)benzoate

IUPAC name

methyl 2-(4-{[2-(4-chlorophenyl)-5-oxo-4H5H6H7H-pyrazolo[15-a]pyrimidin-4-yl]methyl}benzamido)benzoate

SMILES

COC(c(cccc1)c1NC(c1ccc(CN(c2cc(-c(cc3)ccc3Cl)nn2CC2)C2=O)cc1)=O)=O

InChI

InChI=1S/C28H23ClN4O4/c1-37-28(36)22-4-2-3-5-23(22)30-27(35)20-8-6-18(7-9-20)17-32-25-16-24(19-10-12-21(29)13-11-19)31-33(25)15-14-26(32)34/h2-13,16H,14-15,17H2,1H3,(H,30,35)

InChI Key

XZZWSKRZAXSBAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27602882

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

514.97

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.271

Distribution Coefficient, logD

4.861

Water Solubility, LogSw

-5.69

Polar Surface Area

71.588

Acid Dissociation Constant (pKa)

7.20

Base Dissociation Constant (pKb)

-2.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

E856-3150 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

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with E856-3150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E856-3150?
Check Price and Availability of E856-3150, 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.
What is the minimum amount of E856-3150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E856-3150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E856-3150
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of E856-3150 available by request