4813-1505 Screening compound: ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate

4813-1505 Screening compound: ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate
4813-1505 Screening compound: ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4813-1505
ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate

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

4813-1505

Molecular Formula

C12H12N2O3S2 (C12 H12 N2 O3 S2)

Compound Name

ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate

IUPAC name

ethyl 2-[2-(thiophene-2-amido)-13-thiazol-4-yl]acetate

SMILES

CCOC(Cc1csc(NC(c2cccs2)=O)n1)=O

InChI

InChI=1S/C12H12N2O3S2/c1-2-17-10(15)6-8-7-19-12(13-8)14-11(16)9-4-3-5-18-9/h3-5,7H,2,6H2,1H3,(H,13,14,16)

InChI Key

HBYYVOLROLMNNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00751111

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

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.838

Distribution Coefficient, logD

2.829

Water Solubility, LogSw

-3.26

Polar Surface Area

55.048

Acid Dissociation Constant (pKa)

9.07

Base Dissociation Constant (pKb)

-1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

4813-1505 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Receptors Annotated Library (5376 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Proteases

References: we are preparing a list of scientific research reports with 4813-1505 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4813-1505?
Check Price and Availability of 4813-1505, 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 4813-1505 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4813-1505
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4813-1505
  • 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 4813-1505 available by request