E918-0017 Screening compound: 5-methyl-7-(2-methylphenyl)-N3,N6-diphenyl-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide

E918-0017 Screening compound: 5-methyl-7-(2-methylphenyl)-N3,N6-diphenyl-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide
E918-0017 Screening compound: 5-methyl-7-(2-methylphenyl)-N3,N6-diphenyl-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E918-0017
5-methyl-7-(2-methylphenyl)-N3,N6-diphenyl-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-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

E918-0017

Molecular Formula

C28H25N5O2 (C28 H25 N5 O2)

Compound Name

5-methyl-7-(2-methylphenyl)-N3,N6-diphenyl-4H,7H-pyrazolo[1,5-a]pyrimidine-3,6-dicarboxamide

IUPAC name

5-methyl-7-(2-methylphenyl)-N3N6-diphenyl-4H7H-pyrazolo[15-a]pyrimidine-36-dicarboxamide

SMILES

Cc1c(C2n3ncc(C(Nc4ccccc4)=O)c3NC(C)=C2C(Nc2ccccc2)=O)cccc1

InChI

InChI=1S/C28H25N5O2/c1-18-11-9-10-16-22(18)25-24(28(35)32-21-14-7-4-8-15-21)19(2)30-26-23(17-29-33(25)26)27(34)31-20-12-5-3-6-13-20/h3-17,25,30H,1-2H3,(H,31,34)(H,32,35)/t25-/m0/s1

InChI Key

INPOROKZGYHZPA-VWLOTQADSA-N

MDL Number (MFCD)

MFCD14927644

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.762

Distribution Coefficient, logD

4.761

Water Solubility, LogSw

-4.42

Polar Surface Area

70.346

Acid Dissociation Constant (pKa)

10.02

Base Dissociation Constant (pKb)

-1.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.71

E918-0017 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E918-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E918-0017?
Check Price and Availability of E918-0017, 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 E918-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E918-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E918-0017
  • 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 E918-0017 available by request