G586-0696 Screening compound: 8-chloro-N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-7-methoxythieno[2,3-b]quinoline-2-carboxamide

G586-0696 Screening compound: 8-chloro-N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-7-methoxythieno[2,3-b]quinoline-2-carboxamide
G586-0696 Screening compound: 8-chloro-N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-7-methoxythieno[2,3-b]quinoline-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G586-0696
8-chloro-N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-7-methoxythieno[2,3-b]quinoline-2-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

G586-0696

Molecular Formula

C26H25Cl2N3O2S (C26 H25 Cl2 N3 O2 S)

Compound Name

8-chloro-N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-7-methoxythieno[2,3-b]quinoline-2-carboxamide

IUPAC name

8-chloro-N-({1-[(4-chlorophenyl)methyl]piperidin-4-yl}methyl)-7-methoxythieno[23-b]quinoline-2-carboxamide

SMILES

COc(ccc(c1n2)cc3c2sc(C(NCC2CCN(Cc(cc4)ccc4Cl)CC2)=O)c3)c1Cl

InChI

InChI=1S/C26H25Cl2N3O2S/c1-33-21-7-4-18-12-19-13-22(34-26(19)30-24(18)23(21)28)25(32)29-14-16-8-10-31(11-9-16)15-17-2-5-20(27)6-3-17/h2-7,12-13,16H,8-11,14-15H2,1H3,(H,29,32)

InChI Key

ORHWDYXPEIBQDE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27145131

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

514.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.409

Distribution Coefficient, logD

4.772

Water Solubility, LogSw

-6.54

Polar Surface Area

46.221

Acid Dissociation Constant (pKa)

13.62

Base Dissociation Constant (pKb)

9.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

G586-0696 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G586-0696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G586-0696?
Check Price and Availability of G586-0696, 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 G586-0696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G586-0696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G586-0696
  • 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 G586-0696 available by request