6721-0029 Screening compound: 2-{2-[(4-hydroxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetic acid

6721-0029 Screening compound: 2-{2-[(4-hydroxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetic acid
6721-0029 Screening compound: 2-{2-[(4-hydroxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 6721-0029
2-{2-[(4-hydroxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetic 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

6721-0029

Molecular Formula

C11H10N2O4S (C11 H10 N2 O4 S)

Compound Name

2-{2-[(4-hydroxyphenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-yl}acetic acid

IUPAC name

2-{2-[(4-hydroxyphenyl)amino]-4-oxo-45-dihydro-13-thiazol-5-yl}acetic acid

SMILES

OC(CC1SC(Nc(cc2)ccc2O)=NC1=O)=O

InChI

InChI=1S/C11H10N2O4S/c14-7-3-1-6(2-4-7)12-11-13-10(17)8(18-11)5-9(15)16/h1-4,8,14H,5H2,(H,15,16)(H,12,13,17)/t8-/m0/s1

InChI Key

GEJQZHHQJXYOKV-QMMMGPOBSA-N

MDL Number (MFCD)

MFCD03618894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

266.28

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.243

Distribution Coefficient, logD

-2.543

Water Solubility, LogSw

-1.99

Polar Surface Area

77.897

Acid Dissociation Constant (pKa)

4.61

Base Dissociation Constant (pKb)

1.70

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.18

6721-0029 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6721-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6721-0029?
Check Price and Availability of 6721-0029, 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 6721-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6721-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6721-0029
  • 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 6721-0029 available by request