7213-0623 Screening compound: 7-(difluoromethyl)-N-(4-ethoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

7213-0623 Screening compound: 7-(difluoromethyl)-N-(4-ethoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
7213-0623 Screening compound: 7-(difluoromethyl)-N-(4-ethoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7213-0623
7-(difluoromethyl)-N-(4-ethoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

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

7213-0623

Molecular Formula

C16H15F2N5O2 (C16 H15 F2 N5 O2)

Compound Name

7-(difluoromethyl)-N-(4-ethoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

IUPAC name

7-(difluoromethyl)-N-(4-ethoxyphenyl)-5-methyl-[124]triazolo[15-a]pyrimidine-2-carboxamide

SMILES

CCOc(cc1)ccc1NC(c1nn2c(C(F)F)cc(C)nc2n1)=O

InChI

InChI=1S/C16H15F2N5O2/c1-3-25-11-6-4-10(5-7-11)20-15(24)14-21-16-19-9(2)8-12(13(17)18)23(16)22-14/h4-8,13H,3H2,1-2H3,(H,20,24)

InChI Key

ZZNYFJGKOVWMLZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02175829

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.227

Distribution Coefficient, logD

2.227

Water Solubility, LogSw

-2.90

Polar Surface Area

60.074

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

2.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

7213-0623 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 7213-0623 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7213-0623?
Check Price and Availability of 7213-0623, 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 7213-0623 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7213-0623
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7213-0623
  • 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 7213-0623 available by request