G786-0956 Screening compound: 4-(4-benzylpiperidino)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine

G786-0956 Screening compound: 4-(4-benzylpiperidino)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine
G786-0956 Screening compound: 4-(4-benzylpiperidino)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound G786-0956
4-(4-benzylpiperidino)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine

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

G786-0956

Molecular Formula

C21H23N3S (C21 H23 N3 S)

Compound Name

4-(4-benzylpiperidino)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine

IUPAC name

12-(4-benzylpiperidin-1-yl)-7-thia-911-diazatricyclo[6.4.0.0^{26}]dodeca-1(8)2(6)911-tetraene

SMILES

C(C(CC1)CCN1c1c(c(CCC2)c2s2)c2ncn1)c1ccccc1

InChI

InChI=1S/C21H23N3S/c1-2-5-15(6-3-1)13-16-9-11-24(12-10-16)20-19-17-7-4-8-18(17)25-21(19)23-14-22-20/h1-3,5-6,14,16H,4,7-13H2

InChI Key

ADVCOZAITDWYMV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03761873

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.5

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.930

Distribution Coefficient, logD

5.917

Water Solubility, LogSw

-6.34

Polar Surface Area

24.553

Acid Dissociation Constant (pKa)

20.36

Base Dissociation Constant (pKb)

5.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

G786-0956 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

GPCR Targeted Library (31838 compounds)

KRAS-Targeted Library (16000 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:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Kinases
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G786-0956 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G786-0956?
Check Price and Availability of G786-0956, 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 G786-0956 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G786-0956
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G786-0956
  • 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 G786-0956 available by request