G541-0669 Screening compound: 1,8-dimethyl-N-{4-[(4-methylpiperidin-1-yl)methyl]phenyl}-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide

G541-0669 Screening compound: 1,8-dimethyl-N-{4-[(4-methylpiperidin-1-yl)methyl]phenyl}-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide
G541-0669 Screening compound: 1,8-dimethyl-N-{4-[(4-methylpiperidin-1-yl)methyl]phenyl}-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G541-0669
1,8-dimethyl-N-{4-[(4-methylpiperidin-1-yl)methyl]phenyl}-1H,4H-thiochromeno[4,3-c]pyrazole-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

G541-0669

Molecular Formula

C26H30N4OS (C26 H30 N4 OS)

Compound Name

1,8-dimethyl-N-{4-[(4-methylpiperidin-1-yl)methyl]phenyl}-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide

IUPAC name

18-dimethyl-N-{4-[(4-methylpiperidin-1-yl)methyl]phenyl}-1H4H-thiochromeno[43-c]pyrazole-3-carboxamide

SMILES

CC1CCN(Cc(cc2)ccc2NC(c2nn(C)c-3c2CSc2c3cc(C)cc2)=O)CC1

InChI

InChI=1S/C26H30N4OS/c1-17-10-12-30(13-11-17)15-19-5-7-20(8-6-19)27-26(31)24-22-16-32-23-9-4-18(2)14-21(23)25(22)29(3)28-24/h4-9,14,17H,10-13,15-16H2,1-3H3,(H,27,31)

InChI Key

MJIRPZUUKYLCTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15017682

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.62

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.794

Distribution Coefficient, logD

3.344

Water Solubility, LogSw

-4.40

Polar Surface Area

41.385

Acid Dissociation Constant (pKa)

11.21

Base Dissociation Constant (pKb)

8.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

G541-0669 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CNS Targets (44014 compounds)

Hsp90-Targeted Library (11355 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:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune 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 G541-0669 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G541-0669?
Check Price and Availability of G541-0669, 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 G541-0669 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G541-0669
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G541-0669
  • 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 G541-0669 available by request