G540-0848 Screening compound: 4-benzyl-1-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine

G540-0848 Screening compound: 4-benzyl-1-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine
G540-0848 Screening compound: 4-benzyl-1-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound G540-0848
4-benzyl-1-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine

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

G540-0848

Molecular Formula

C24H22ClN3S (C24 H22 ClN3 S)

Compound Name

4-benzyl-1-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine

IUPAC name

4-benzyl-1-[5-(4-chlorophenyl)thieno[23-d]pyrimidin-4-yl]piperidine

SMILES

Clc(cc1)ccc1-c1csc2ncnc(N3CCC(Cc4ccccc4)CC3)c12

InChI

InChI=1S/C24H22ClN3S/c25-20-8-6-19(7-9-20)21-15-29-24-22(21)23(26-16-27-24)28-12-10-18(11-13-28)14-17-4-2-1-3-5-17/h1-9,15-16,18H,10-14H2

InChI Key

RAFRCKKLXPAZKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03967295

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.98

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.462

Distribution Coefficient, logD

7.458

Water Solubility, LogSw

-6.95

Polar Surface Area

23.995

Acid Dissociation Constant (pKa)

21.66

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G540-0848 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Glucocorticoid receptors Library (4806 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Nuclear receptors
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G540-0848 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G540-0848?
Check Price and Availability of G540-0848, 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 G540-0848 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G540-0848
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G540-0848
  • 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 G540-0848 available by request