0850-0341 Screening compound: 2,5-dichlorophenyl 4-[(E)-{[4-(1,3-benzoxazol-2-yl)phenyl]imino}methyl]benzoate

0850-0341 Screening compound: 2,5-dichlorophenyl 4-[(E)-{[4-(1,3-benzoxazol-2-yl)phenyl]imino}methyl]benzoate
0850-0341 Screening compound: 2,5-dichlorophenyl 4-[(E)-{[4-(1,3-benzoxazol-2-yl)phenyl]imino}methyl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0850-0341
2,5-dichlorophenyl 4-[(E)-{[4-(1,3-benzoxazol-2-yl)phenyl]imino}methyl]benzoate

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

0850-0341

Molecular Formula

C27H16Cl2N2O3 (C27 H16 Cl2 N2 O3)

Compound Name

2,5-dichlorophenyl 4-[(E)-{[4-(1,3-benzoxazol-2-yl)phenyl]imino}methyl]benzoate

IUPAC name

25-dichlorophenyl 4-[(E)-{[4-(13-benzoxazol-2-yl)phenyl]imino}methyl]benzoate

SMILES

O=C(c1ccc(/C=N/c(cc2)ccc2-c2nc(cccc3)c3o2)cc1)Oc(cc(cc1)Cl)c1Cl

InChI

InChI=1S/C27H16Cl2N2O3/c28-20-11-14-22(29)25(15-20)34-27(32)19-7-5-17(6-8-19)16-30-21-12-9-18(10-13-21)26-31-23-3-1-2-4-24(23)33-26/h1-16H

InChI Key

FXRSJQLEQMIFSU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00290256

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.934

Distribution Coefficient, logD

6.934

Water Solubility, LogSw

-6.70

Polar Surface Area

45.641

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

4.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0850-0341 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 0850-0341 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0850-0341?
Check Price and Availability of 0850-0341, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 0850-0341 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0850-0341
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0850-0341
  • 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 0850-0341 available by request