G887-0693 Screening compound: 1-{6-ethylthieno[2,3-d]pyrimidin-4-yl}-N-[(4-fluorophenyl)methyl]piperidine-3-carboxamide

G887-0693 Screening compound: 1-{6-ethylthieno[2,3-d]pyrimidin-4-yl}-N-[(4-fluorophenyl)methyl]piperidine-3-carboxamide
G887-0693 Screening compound: 1-{6-ethylthieno[2,3-d]pyrimidin-4-yl}-N-[(4-fluorophenyl)methyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G887-0693
1-{6-ethylthieno[2,3-d]pyrimidin-4-yl}-N-[(4-fluorophenyl)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

G887-0693

Molecular Formula

C21H23FN4OS (C21 H23 FN4 OS)

Compound Name

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

IUPAC name

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

SMILES

CCc1cc2c(N(CCC3)CC3C(NCc(cc3)ccc3F)=O)ncnc2s1

InChI

InChI=1S/C21H23FN4OS/c1-2-17-10-18-19(24-13-25-21(18)28-17)26-9-3-4-15(12-26)20(27)23-11-14-5-7-16(22)8-6-14/h5-8,10,13,15H,2-4,9,11-12H2,1H3,(H,23,27)/t15-/m0/s1

InChI Key

XBOLGYURICPCEK-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD15072938

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.874

Distribution Coefficient, logD

3.851

Water Solubility, LogSw

-3.79

Polar Surface Area

48.885

Acid Dissociation Constant (pKa)

11.94

Base Dissociation Constant (pKb)

6.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

G887-0693 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G887-0693 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G887-0693?
Check Price and Availability of G887-0693, 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 G887-0693 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G887-0693
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G887-0693
  • 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 G887-0693 available by request