G541-1454 Screening compound: 1-{8-fluoro-1-methyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carbonyl}-2,3-dihydro-1H-indole

G541-1454 Screening compound: 1-{8-fluoro-1-methyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carbonyl}-2,3-dihydro-1H-indole
G541-1454 Screening compound: 1-{8-fluoro-1-methyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carbonyl}-2,3-dihydro-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound G541-1454
1-{8-fluoro-1-methyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carbonyl}-2,3-dihydro-1H-indole

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

G541-1454

Molecular Formula

C20H16FN3OS (C20 H16 FN3 OS)

Compound Name

1-{8-fluoro-1-methyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carbonyl}-2,3-dihydro-1H-indole

IUPAC name

1-{8-fluoro-1-methyl-1H4H-thiochromeno[43-c]pyrazole-3-carbonyl}-23-dihydro-1H-indole

SMILES

Cn1nc(C(N(CC2)c3c2cccc3)=O)c2c1-c(cc(cc1)F)c1SC2

InChI

InChI=1S/C20H16FN3OS/c1-23-19-14-10-13(21)6-7-17(14)26-11-15(19)18(22-23)20(25)24-9-8-12-4-2-3-5-16(12)24/h2-7,10H,8-9,11H2,1H3

InChI Key

AMMMEYUQZHKXNB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27143025

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.748

Distribution Coefficient, logD

3.748

Water Solubility, LogSw

-4.02

Polar Surface Area

30.240

Acid Dissociation Constant (pKa)

18.79

Base Dissociation Constant (pKb)

-1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G541-1454 in Drug Discovery

Included in Screening Libraries

Hsp90-Targeted Library (11355 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Immune system
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G541-1454 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G541-1454?
Check Price and Availability of G541-1454, 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 G541-1454 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G541-1454
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G541-1454
  • 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 G541-1454 available by request