2188-2083 Screening compound: (2Z)-3-(2-chlorophenyl)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

2188-2083 Screening compound: (2Z)-3-(2-chlorophenyl)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
2188-2083 Screening compound: (2Z)-3-(2-chlorophenyl)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 2188-2083
(2Z)-3-(2-chlorophenyl)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

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

2188-2083

Molecular Formula

C21H11ClN2O2S (C21 H11 ClN2 O2 S)

Compound Name

(2Z)-3-(2-chlorophenyl)-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

IUPAC name

(2Z)-3-(2-chlorophenyl)-2-[4-(2-oxo-2H-chromen-3-yl)-13-thiazol-2-yl]prop-2-enenitrile

SMILES

N#C/C(/c1nc(C2=Cc(cccc3)c3OC2=O)cs1)=C/c(cccc1)c1Cl

InChI

InChI=1S/C21H11ClN2O2S/c22-17-7-3-1-5-13(17)9-15(11-23)20-24-18(12-27-20)16-10-14-6-2-4-8-19(14)26-21(16)25/h1-10,12H

InChI Key

UCAOJAMFOAUZOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01541477

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.85

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.290

Distribution Coefficient, logD

5.290

Water Solubility, LogSw

-5.92

Polar Surface Area

47.679

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-7.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2188-2083 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 2188-2083 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2188-2083?
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What is the minimum amount of 2188-2083 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2188-2083
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2188-2083
  • 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 2188-2083 available by request