8010-5835 Screening compound: methyl 4,5-dimethyl-2-(1-methyl-1H-pyrazole-5-amido)thiophene-3-carboxylate

8010-5835 Screening compound: methyl 4,5-dimethyl-2-(1-methyl-1H-pyrazole-5-amido)thiophene-3-carboxylate
8010-5835 Screening compound: methyl 4,5-dimethyl-2-(1-methyl-1H-pyrazole-5-amido)thiophene-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-5835
methyl 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

8010-5835

Molecular Formula

C13H15N3O3S (C13 H15 N3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(C)sc(NC(c2ccnn2C)=O)c1C(OC)=O

InChI

InChI=1S/C13H15N3O3S/c1-7-8(2)20-12(10(7)13(18)19-4)15-11(17)9-5-6-14-16(9)3/h5-6H,1-4H3,(H,15,17)

InChI Key

IYFARNKNJGYBOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01892217

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.672

Distribution Coefficient, logD

-2.074

Water Solubility, LogSw

-2.39

Polar Surface Area

57.948

Acid Dissociation Constant (pKa)

3.65

Base Dissociation Constant (pKb)

-1.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

8010-5835 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 8010-5835 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-5835?
Check Price and Availability of 8010-5835, 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 8010-5835 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-5835
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-5835
  • 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 8010-5835 available by request