1988-2210 Screening compound: ethyl 2-[2-(4-fluorobenzamido)-1,3-thiazol-4-yl]acetate

1988-2210 Screening compound: ethyl 2-[2-(4-fluorobenzamido)-1,3-thiazol-4-yl]acetate
1988-2210 Screening compound: ethyl 2-[2-(4-fluorobenzamido)-1,3-thiazol-4-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1988-2210
ethyl 2-[2-(4-fluorobenzamido)-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

1988-2210

Molecular Formula

C14H13FN2O3S (C14 H13 FN2 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCOC(Cc1csc(NC(c(cc2)ccc2F)=O)n1)=O

InChI

InChI=1S/C14H13FN2O3S/c1-2-20-12(18)7-11-8-21-14(16-11)17-13(19)9-3-5-10(15)6-4-9/h3-6,8H,2,7H2,1H3,(H,16,17,19)

InChI Key

ZBUOVAQYTXOIPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00751091

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.33

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

2.955

Distribution Coefficient, logD

2.563

Water Solubility, LogSw

-3.43

Polar Surface Area

54.030

Acid Dissociation Constant (pKa)

7.23

Base Dissociation Constant (pKb)

-1.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

1988-2210 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

Dark Chemical Matter Library (18430 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
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Proteases
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1988-2210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1988-2210?
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What is the minimum amount of 1988-2210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1988-2210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1988-2210
  • 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 1988-2210 available by request