E984-1870 Screening compound: N-[(3-methylphenyl)methyl]-2-{5-oxo-2-phenyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}acetamide

E984-1870 Screening compound: N-[(3-methylphenyl)methyl]-2-{5-oxo-2-phenyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}acetamide
E984-1870 Screening compound: N-[(3-methylphenyl)methyl]-2-{5-oxo-2-phenyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E984-1870
N-[(3-methylphenyl)methyl]-2-{5-oxo-2-phenyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}acetamide

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

E984-1870

Molecular Formula

C22H22N4O2 (C22 H22 N4 O2)

Compound Name

N-[(3-methylphenyl)methyl]-2-{5-oxo-2-phenyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}acetamide

IUPAC name

N-[(3-methylphenyl)methyl]-2-{5-oxo-2-phenyl-4H5H6H7H-pyrazolo[15-a]pyrimidin-4-yl}acetamide

SMILES

Cc1cccc(CNC(CN(c2cc(-c3ccccc3)nn2CC2)C2=O)=O)c1

InChI

InChI=1S/C22H22N4O2/c1-16-6-5-7-17(12-16)14-23-20(27)15-25-21-13-19(18-8-3-2-4-9-18)24-26(21)11-10-22(25)28/h2-9,12-13H,10-11,14-15H2,1H3,(H,23,27)

InChI Key

XJINDEYBNVYHIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14936061

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.490

Distribution Coefficient, logD

3.490

Water Solubility, LogSw

-3.67

Polar Surface Area

52.492

Acid Dissociation Constant (pKa)

13.05

Base Dissociation Constant (pKb)

-1.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

E984-1870 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E984-1870 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E984-1870?
Check Price and Availability of E984-1870, 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 E984-1870 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E984-1870
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E984-1870
  • 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 E984-1870 available by request