D703-0234 Screening compound: (2E)-N-{4-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,3-thiazol-2-yl}-3-phenylprop-2-enamide

D703-0234 Screening compound: (2E)-N-{4-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,3-thiazol-2-yl}-3-phenylprop-2-enamide
D703-0234 Screening compound: (2E)-N-{4-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,3-thiazol-2-yl}-3-phenylprop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D703-0234
(2E)-N-{4-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,3-thiazol-2-yl}-3-phenylprop-2-enamide

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

D703-0234

Molecular Formula

C22H18N4O2S (C22 H18 N4 O2 S)

Compound Name

(2E)-N-{4-methyl-5-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,3-thiazol-2-yl}-3-phenylprop-2-enamide

IUPAC name

(2E)-N-{4-methyl-5-[3-(4-methylphenyl)-124-oxadiazol-5-yl]-13-thiazol-2-yl}-3-phenylprop-2-enamide

SMILES

Cc1c(-c2nc(-c3ccc(C)cc3)no2)sc(NC(/C=C/c2ccccc2)=O)n1

InChI

InChI=1S/C22H18N4O2S/c1-14-8-11-17(12-9-14)20-25-21(28-26-20)19-15(2)23-22(29-19)24-18(27)13-10-16-6-4-3-5-7-16/h3-13H,1-2H3,(H,23,24,27)

InChI Key

PWGSJSRQCIBRKB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27597070

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.185

Distribution Coefficient, logD

6.184

Water Solubility, LogSw

-5.68

Polar Surface Area

65.145

Acid Dissociation Constant (pKa)

9.99

Base Dissociation Constant (pKb)

-0.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

D703-0234 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with D703-0234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D703-0234?
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What is the minimum amount of D703-0234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D703-0234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D703-0234
  • 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 D703-0234 available by request