3331-2708 Screening compound: 3-[(5Z)-2,4-dioxo-5-(phenylmethylidene)-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)propanamide

3331-2708 Screening compound: 3-[(5Z)-2,4-dioxo-5-(phenylmethylidene)-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)propanamide
3331-2708 Screening compound: 3-[(5Z)-2,4-dioxo-5-(phenylmethylidene)-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3331-2708
3-[(5Z)-2,4-dioxo-5-(phenylmethylidene)-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)propanamide

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

3331-2708

Molecular Formula

C20H18N2O3S (C20 H18 N2 O3 S)

Compound Name

3-[(5Z)-2,4-dioxo-5-(phenylmethylidene)-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)propanamide

IUPAC name

3-[(5Z)-24-dioxo-5-(phenylmethylidene)-13-thiazolidin-3-yl]-N-(4-methylphenyl)propanamide

SMILES

Cc(cc1)ccc1NC(CCN(C(/C(/S1)=C/c2ccccc2)=O)C1=O)=O

InChI

InChI=1S/C20H18N2O3S/c1-14-7-9-16(10-8-14)21-18(23)11-12-22-19(24)17(26-20(22)25)13-15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H,21,23)

InChI Key

CMRSXARHSJRBOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01462830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.138

Distribution Coefficient, logD

4.138

Water Solubility, LogSw

-4.09

Polar Surface Area

52.723

Acid Dissociation Constant (pKa)

12.06

Base Dissociation Constant (pKb)

-0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with 3331-2708 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3331-2708?
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What is the minimum amount of 3331-2708 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3331-2708
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3331-2708
  • 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 3331-2708 available by request