FF53-2039 Screening compound: 4-methyl-2-(propan-2-yloxy)-1,3-thiazole-5-carboxylic acid

FF53-2039 Screening compound: 4-methyl-2-(propan-2-yloxy)-1,3-thiazole-5-carboxylic acid
FF53-2039 Screening compound: 4-methyl-2-(propan-2-yloxy)-1,3-thiazole-5-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound FF53-2039
4-methyl-2-(propan-2-yloxy)-1,3-thiazole-5-carboxylic acid

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

FF53-2039

Molecular Formula

C8H11NO3S (C8 H11 NO3 S)

Compound Name

4-methyl-2-(propan-2-yloxy)-1,3-thiazole-5-carboxylic acid

IUPAC name

4-methyl-2-(propan-2-yloxy)-13-thiazole-5-carboxylic acid

SMILES

CC(C)Oc1nc(C)c(C(O)=O)s1

InChI

InChI=1S/C8H11NO3S/c1-4(2)12-8-9-5(3)6(13-8)7(10)11/h4H,1-3H3,(H,10,11)

InChI Key

DGFJLZVNVMIESZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22201639

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

201.25

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.750

Distribution Coefficient, logD

-2.551

Water Solubility, LogSw

-1.72

Polar Surface Area

47.821

Acid Dissociation Constant (pKa)

3.10

Base Dissociation Constant (pKb)

1.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

FF53-2039 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with FF53-2039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound FF53-2039?
Check Price and Availability of FF53-2039, 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 FF53-2039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for FF53-2039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for FF53-2039
  • 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 FF53-2039 available by request