4168-1925 Screening compound: ethyl 4-methyl-2-propanamido-1,3-thiazole-5-carboxylate

4168-1925 Screening compound: ethyl 4-methyl-2-propanamido-1,3-thiazole-5-carboxylate
4168-1925 Screening compound: ethyl 4-methyl-2-propanamido-1,3-thiazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4168-1925
ethyl 4-methyl-2-propanamido-1,3-thiazole-5-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

4168-1925

Molecular Formula

C10H14N2O3S (C10 H14 N2 O3 S)

Compound Name

ethyl 4-methyl-2-propanamido-1,3-thiazole-5-carboxylate

IUPAC name

ethyl 4-methyl-2-propanamido-13-thiazole-5-carboxylate

SMILES

CCC(Nc1nc(C)c(C(OCC)=O)s1)=O

InChI

InChI=1S/C10H14N2O3S/c1-4-7(13)12-10-11-6(3)8(16-10)9(14)15-5-2/h4-5H2,1-3H3,(H,11,12,13)

InChI Key

ARGNMISXQRRJMU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00980289

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

242.3

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

2.018

Distribution Coefficient, logD

1.968

Water Solubility, LogSw

-2.44

Polar Surface Area

54.765

Acid Dissociation Constant (pKa)

8.31

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

4168-1925 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 4168-1925 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4168-1925?
Check Price and Availability of 4168-1925, 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 4168-1925 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4168-1925
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4168-1925
  • 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 4168-1925 available by request