D306-0357 Screening compound: 4-{[(6-phenylpyrimidin-4-yl)sulfanyl]methyl}benzoic acid

D306-0357 Screening compound: 4-{[(6-phenylpyrimidin-4-yl)sulfanyl]methyl}benzoic acid
D306-0357 Screening compound: 4-{[(6-phenylpyrimidin-4-yl)sulfanyl]methyl}benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound D306-0357
4-{[(6-phenylpyrimidin-4-yl)sulfanyl]methyl}benzoic 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

D306-0357

Molecular Formula

C18H14N2O2S (C18 H14 N2 O2 S)

Compound Name

4-{[(6-phenylpyrimidin-4-yl)sulfanyl]methyl}benzoic acid

IUPAC name

4-{[(6-phenylpyrimidin-4-yl)sulfanyl]methyl}benzoic acid

SMILES

OC(c1ccc(CSc2ncnc(-c3ccccc3)c2)cc1)=O

InChI

InChI=1S/C18H14N2O2S/c21-18(22)15-8-6-13(7-9-15)11-23-17-10-16(19-12-20-17)14-4-2-1-3-5-14/h1-10,12H,11H2,(H,21,22)

InChI Key

WXJQBYLTYYDEKK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10480177

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.194

Distribution Coefficient, logD

1.222

Water Solubility, LogSw

-4.28

Polar Surface Area

47.274

Acid Dissociation Constant (pKa)

4.43

Base Dissociation Constant (pKb)

4.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

D306-0357 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • Epigenetic

References: we are preparing a list of scientific research reports with D306-0357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D306-0357?
Check Price and Availability of D306-0357, 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 D306-0357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D306-0357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D306-0357
  • 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 D306-0357 available by request