J093-0667 Screening compound: 1-[5-(furan-2-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl]-4-phenylpiperazine

J093-0667 Screening compound: 1-[5-(furan-2-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl]-4-phenylpiperazine
J093-0667 Screening compound: 1-[5-(furan-2-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl]-4-phenylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound J093-0667
1-[5-(furan-2-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl]-4-phenylpiperazine

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

J093-0667

Molecular Formula

C21H17F3N6O2 (C21 H17 F3 N6 O2)

Compound Name

1-[5-(furan-2-yl)-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbonyl]-4-phenylpiperazine

IUPAC name

1-[5-(furan-2-yl)-7-(trifluoromethyl)-[124]triazolo[15-a]pyrimidine-2-carbonyl]-4-phenylpiperazine

SMILES

O=C(c1nn2c(C(F)(F)F)cc(-c3ccco3)nc2n1)N(CC1)CCN1c1ccccc1

InChI

InChI=1S/C21H17F3N6O2/c22-21(23,24)17-13-15(16-7-4-12-32-16)25-20-26-18(27-30(17)20)19(31)29-10-8-28(9-11-29)14-5-2-1-3-6-14/h1-7,12-13H,8-11H2

InChI Key

NHJBMPZJUPODEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15080555

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.214

Distribution Coefficient, logD

3.214

Water Solubility, LogSw

-3.33

Polar Surface Area

58.268

Acid Dissociation Constant (pKa)

28.55

Base Dissociation Constant (pKb)

5.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

J093-0667 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with J093-0667 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J093-0667?
Check Price and Availability of J093-0667, 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 J093-0667 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J093-0667
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J093-0667
  • 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 J093-0667 available by request