Y206-0510 Screening compound: ethyl 3-methyl-5-[(2-thienylcarbonyl)amino]-4-isothiazolecarboxylate

Y206-0510 Screening compound: ethyl 3-methyl-5-[(2-thienylcarbonyl)amino]-4-isothiazolecarboxylate
Y206-0510 Screening compound: ethyl 3-methyl-5-[(2-thienylcarbonyl)amino]-4-isothiazolecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y206-0510
ethyl 3-methyl-5-[(2-thienylcarbonyl)amino]-4-isothiazolecarboxylate

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

Y206-0510

Molecular Formula

C12H12N2O3S2 (C12 H12 N2 O3 S2)

Compound Name

ethyl 3-methyl-5-[(2-thienylcarbonyl)amino]-4-isothiazolecarboxylate

IUPAC name

ethyl 3-methyl-5-(thiophene-2-amido)-12-thiazole-4-carboxylate

SMILES

CCOC(c1c(NC(c2cccs2)=O)snc1C)=O

InChI

InChI=1S/C12H12N2O3S2/c1-3-17-12(16)9-7(2)14-19-11(9)13-10(15)8-5-4-6-18-8/h4-6H,3H2,1-2H3,(H,13,15)

InChI Key

IIBZGXJEJSCTGS-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.424

Distribution Coefficient, logD

-0.210

Water Solubility, LogSw

-2.80

Polar Surface Area

54.946

Acid Dissociation Constant (pKa)

4.77

Base Dissociation Constant (pKb)

-5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

Y206-0510 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y206-0510 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y206-0510?
Check Price and Availability of Y206-0510, 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 Y206-0510 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y206-0510
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y206-0510
  • 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 Y206-0510 available by request