1426-2772 Screening compound: ethyl 4,5-dimethyl-2-(1-methyl-1H-pyrazole-5-amido)thiophene-3-carboxylate

1426-2772 Screening compound: ethyl 4,5-dimethyl-2-(1-methyl-1H-pyrazole-5-amido)thiophene-3-carboxylate
1426-2772 Screening compound: ethyl 4,5-dimethyl-2-(1-methyl-1H-pyrazole-5-amido)thiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1426-2772
ethyl 4,5-dimethyl-2-(1-methyl-1H-pyrazole-5-amido)thiophene-3-carboxylate

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

1426-2772

Molecular Formula

C14H17N3O3S (C14 H17 N3 O3 S)

Compound Name

ethyl 4,5-dimethyl-2-(1-methyl-1H-pyrazole-5-amido)thiophene-3-carboxylate

IUPAC name

ethyl 45-dimethyl-2-(1-methyl-1H-pyrazole-5-amido)thiophene-3-carboxylate

SMILES

CCOC(c1c(NC(c2ccnn2C)=O)sc(C)c1C)=O

InChI

InChI=1S/C14H17N3O3S/c1-5-20-14(19)11-8(2)9(3)21-13(11)16-12(18)10-6-7-15-17(10)4/h6-7H,5H2,1-4H3,(H,16,18)

InChI Key

MWJXAQQKHTYNRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00419607

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.054

Distribution Coefficient, logD

-1.691

Water Solubility, LogSw

-2.73

Polar Surface Area

57.528

Acid Dissociation Constant (pKa)

3.65

Base Dissociation Constant (pKb)

-1.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

1426-2772 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Dark Chemical Matter Library (18430 compounds)

Frequent Hitters Library (7624 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Structure:
  • Pool
  • Pool

References: we are preparing a list of scientific research reports with 1426-2772 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1426-2772?
Check Price and Availability of 1426-2772, 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 1426-2772 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1426-2772
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1426-2772
  • 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 1426-2772 available by request