G540-0762 Screening compound: N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine

G540-0762 Screening compound: N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine
G540-0762 Screening compound: N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound G540-0762
N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine

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

G540-0762

Molecular Formula

C26H27FN4OS (C26 H27 FN4 OS)

Compound Name

N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine

IUPAC name

N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-5-(4-methoxyphenyl)thieno[23-d]pyrimidin-4-amine

SMILES

COc(cc1)ccc1-c1csc2ncnc(NCC3CCN(Cc4cc(F)ccc4)CC3)c12

InChI

InChI=1S/C26H27FN4OS/c1-32-22-7-5-20(6-8-22)23-16-33-26-24(23)25(29-17-30-26)28-14-18-9-11-31(12-10-18)15-19-3-2-4-21(27)13-19/h2-8,13,16-18H,9-12,14-15H2,1H3,(H,28,29,30)

InChI Key

NNDNSSIQLUMCOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15017574

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.59

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.801

Distribution Coefficient, logD

3.919

Water Solubility, LogSw

-6.04

Polar Surface Area

43.032

Acid Dissociation Constant (pKa)

18.74

Base Dissociation Constant (pKb)

9.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

G540-0762 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

KRAS-Targeted Library (16000 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Kinases
  • Kinases
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G540-0762 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G540-0762?
Check Price and Availability of G540-0762, 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 G540-0762 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G540-0762
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G540-0762
  • 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 G540-0762 available by request