2595-0559 Screening compound: N-(2-fluorophenyl)-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide

2595-0559 Screening compound: N-(2-fluorophenyl)-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide
2595-0559 Screening compound: N-(2-fluorophenyl)-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2595-0559
N-(2-fluorophenyl)-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide

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

2595-0559

Molecular Formula

C13H14FN3O2S (C13 H14 FN3 O2 S)

Compound Name

N-(2-fluorophenyl)-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide

IUPAC name

N-(2-fluorophenyl)-2-[(2Z)-3-methyl-2-(methylimino)-4-oxo-13-thiazolidin-5-yl]acetamide

SMILES

CN(C(C(CC(Nc(cccc1)c1F)=O)S1)=O)/C1=N/C

InChI

InChI=1S/C13H14FN3O2S/c1-15-13-17(2)12(19)10(20-13)7-11(18)16-9-6-4-3-5-8(9)14/h3-6,10H,7H2,1-2H3,(H,16,18)/t10-/m0/s1

InChI Key

YCSNRPBNJIJNDF-JTQLQIEISA-N

MDL Number (MFCD)

MFCD01847799

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.217

Distribution Coefficient, logD

1.216

Water Solubility, LogSw

-2.30

Polar Surface Area

50.378

Acid Dissociation Constant (pKa)

10.30

Base Dissociation Constant (pKb)

4.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.80

2595-0559 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Soluble Diversity Library (15920 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 2595-0559 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2595-0559?
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What is the minimum amount of 2595-0559 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2595-0559
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2595-0559
  • 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 2595-0559 available by request