4373-0535 Screening compound: 2-(2-chloro-4-{[(4Z)-1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}-6-ethoxyphenoxy)acetic acid

4373-0535 Screening compound: 2-(2-chloro-4-{[(4Z)-1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}-6-ethoxyphenoxy)acetic acid
4373-0535 Screening compound: 2-(2-chloro-4-{[(4Z)-1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}-6-ethoxyphenoxy)acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 4373-0535
2-(2-chloro-4-{[(4Z)-1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}-6-ethoxyphenoxy)acetic acid

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

4373-0535

Molecular Formula

C21H18Cl2N2O6 (C21 H18 Cl2 N2 O6)

Compound Name

2-(2-chloro-4-{[(4Z)-1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl}-6-ethoxyphenoxy)acetic acid

IUPAC name

2-(2-chloro-4-{[(4Z)-1-[(4-chlorophenyl)methyl]-25-dioxoimidazolidin-4-ylidene]methyl}-6-ethoxyphenoxy)acetic acid

SMILES

CCOc1cc(/C=C(/C(N2Cc(cc3)ccc3Cl)=O)\NC2=O)cc(Cl)c1OCC(O)=O

InChI

InChI=1S/C21H18Cl2N2O6/c1-2-30-17-9-13(7-15(23)19(17)31-11-18(26)27)8-16-20(28)25(21(29)24-16)10-12-3-5-14(22)6-4-12/h3-9H,2,10-11H2,1H3,(H,24,29)(H,26,27)

InChI Key

FBQPHIHOHKHTIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03141149

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.29

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.243

Distribution Coefficient, logD

0.006

Water Solubility, LogSw

-4.39

Polar Surface Area

83.937

Acid Dissociation Constant (pKa)

3.16

Base Dissociation Constant (pKb)

-1.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

4373-0535 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 4373-0535 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4373-0535?
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What is the minimum amount of 4373-0535 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4373-0535
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4373-0535
  • 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 4373-0535 available by request