1416-0474 Screening compound: 2-(4-{[1,1'-biphenyl]-4-yl}-1,3-thiazol-2-yl)-3H-benzo[f]chromen-3-one

1416-0474 Screening compound: 2-(4-{[1,1'-biphenyl]-4-yl}-1,3-thiazol-2-yl)-3H-benzo[f]chromen-3-one
1416-0474 Screening compound: 2-(4-{[1,1'-biphenyl]-4-yl}-1,3-thiazol-2-yl)-3H-benzo[f]chromen-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1416-0474
2-(4-{[1,1'-biphenyl]-4-yl}-1,3-thiazol-2-yl)-3H-benzo[f]chromen-3-one

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

1416-0474

Molecular Formula

C28H17NO2S (C28 H17 NO2 S)

Compound Name

2-(4-{[1,1'-biphenyl]-4-yl}-1,3-thiazol-2-yl)-3H-benzo[f]chromen-3-one

IUPAC name

2-(4-{[11'-biphenyl]-4-yl}-13-thiazol-2-yl)-3H-benzo[f]chromen-3-one

SMILES

O=C(C(c1nc(-c(cc2)ccc2-c2ccccc2)cs1)=C1)Oc2c1c1ccccc1cc2

InChI

InChI=1S/C28H17NO2S/c30-28-24(16-23-22-9-5-4-8-20(22)14-15-26(23)31-28)27-29-25(17-32-27)21-12-10-19(11-13-21)18-6-2-1-3-7-18/h1-17H

InChI Key

KSNHGPJYYIOPLJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00325842

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.639

Distribution Coefficient, logD

7.639

Water Solubility, LogSw

-7.24

Polar Surface Area

30.079

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-6.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1416-0474 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

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

Included in 1.7M Stock Database

Structure:
  • Pool
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 1416-0474 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1416-0474?
Check Price and Availability of 1416-0474, 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 1416-0474 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1416-0474
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1416-0474
  • 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 1416-0474 available by request