0657-0117 Screening compound: 4-(4-phenoxyphenyl)-2-[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-1,3-thiazole

0657-0117 Screening compound: 4-(4-phenoxyphenyl)-2-[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-1,3-thiazole
0657-0117 Screening compound: 4-(4-phenoxyphenyl)-2-[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-1,3-thiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0657-0117
4-(4-phenoxyphenyl)-2-[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-1,3-thiazole

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

0657-0117

Molecular Formula

C30H20N2O2S2 (C30 H20 N2 O2 S2)

Compound Name

4-(4-phenoxyphenyl)-2-[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-1,3-thiazole

IUPAC name

4-(4-phenoxyphenyl)-2-[4-(4-phenoxyphenyl)-13-thiazol-2-yl]-13-thiazole

SMILES

c1c(-c(cc2)ccc2Oc2ccccc2)nc(-c2nc(-c(cc3)ccc3Oc3ccccc3)cs2)s1

InChI

InChI=1S/C30H20N2O2S2/c1-3-7-23(8-4-1)33-25-15-11-21(12-16-25)27-19-35-29(31-27)30-32-28(20-36-30)22-13-17-26(18-14-22)34-24-9-5-2-6-10-24/h1-20H

InChI Key

DCMHTIHPPQABAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00990387

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

504.63

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

9.883

Distribution Coefficient, logD

9.883

Water Solubility, LogSw

-6.52

Polar Surface Area

32.930

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0657-0117 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 0657-0117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0657-0117?
Check Price and Availability of 0657-0117, 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 0657-0117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0657-0117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0657-0117
  • 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 0657-0117 available by request