G887-0782 Screening compound: 1-{6-ethylthieno[2,3-d]pyrimidin-4-yl}-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)piperidine-3-carboxamide

G887-0782 Screening compound: 1-{6-ethylthieno[2,3-d]pyrimidin-4-yl}-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)piperidine-3-carboxamide
G887-0782 Screening compound: 1-{6-ethylthieno[2,3-d]pyrimidin-4-yl}-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G887-0782
1-{6-ethylthieno[2,3-d]pyrimidin-4-yl}-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)piperidine-3-carboxamide

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

G887-0782

Molecular Formula

C28H37N5OS (C28 H37 N5 OS)

Compound Name

1-{6-ethylthieno[2,3-d]pyrimidin-4-yl}-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)piperidine-3-carboxamide

IUPAC name

1-{6-ethylthieno[23-d]pyrimidin-4-yl}-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)piperidine-3-carboxamide

SMILES

CCc1cc2c(N(CCC3)CC3C(NCC3CCN(Cc4cc(C)ccc4)CC3)=O)ncnc2s1

InChI

InChI=1S/C28H37N5OS/c1-3-24-15-25-26(30-19-31-28(25)35-24)33-11-5-8-23(18-33)27(34)29-16-21-9-12-32(13-10-21)17-22-7-4-6-20(2)14-22/h4,6-7,14-15,19,21,23H,3,5,8-13,16-18H2,1-2H3,(H,29,34)/t23-/m0/s1

InChI Key

SVIWLPBAKPMCBX-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD15072981

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.7

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.439

Distribution Coefficient, logD

2.947

Water Solubility, LogSw

-5.42

Polar Surface Area

52.618

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

9.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.60

G887-0782 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Immune system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with G887-0782 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G887-0782?
Check Price and Availability of G887-0782, 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 G887-0782 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G887-0782
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G887-0782
  • 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 G887-0782 available by request