P804-1075 Screening compound: 2-{4-[3-(thiophen-2-yl)-1H-pyrazol-5-yl]piperazine-1-carbonyl}-1H-indole

P804-1075 Screening compound: 2-{4-[3-(thiophen-2-yl)-1H-pyrazol-5-yl]piperazine-1-carbonyl}-1H-indole
P804-1075 Screening compound: 2-{4-[3-(thiophen-2-yl)-1H-pyrazol-5-yl]piperazine-1-carbonyl}-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound P804-1075
2-{4-[3-(thiophen-2-yl)-1H-pyrazol-5-yl]piperazine-1-carbonyl}-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

P804-1075

Molecular Formula

C20H19N5OS (C20 H19 N5 OS)

Compound Name

2-{4-[3-(thiophen-2-yl)-1H-pyrazol-5-yl]piperazine-1-carbonyl}-1H-indole

IUPAC name

2-{4-[3-(thiophen-2-yl)-1H-pyrazol-5-yl]piperazine-1-carbonyl}-1H-indole

SMILES

O=C(c1cc(cccc2)c2[nH]1)N(CC1)CCN1c1cc(-c2cccs2)n[nH]1

InChI

InChI=1S/C20H19N5OS/c26-20(17-12-14-4-1-2-5-15(14)21-17)25-9-7-24(8-10-25)19-13-16(22-23-19)18-6-3-11-27-18/h1-6,11-13,21H,7-10H2,(H,22,23)

InChI Key

XRXJORUSSBVZAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28041982

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.032

Distribution Coefficient, logD

4.032

Water Solubility, LogSw

-4.30

Polar Surface Area

52.468

Acid Dissociation Constant (pKa)

15.07

Base Dissociation Constant (pKb)

0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

P804-1075 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral HBV Library (10007 compounds)

Bcl2-PPI Inhibitors Library (12246 compounds)

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

GPCR Targeted Library (31838 compounds)

Indole Derivatives (10091 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Hemic and lymphatic
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Antiviral
  • Infections
  • Immune system
  • Cancer
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
  • PPI modulators
Targets:
  • GPCR
Structure:
  • Cyclic compounds
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P804-1075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P804-1075?
Check Price and Availability of P804-1075, 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 P804-1075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P804-1075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P804-1075
  • 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 P804-1075 available by request