P094-1969 Screening compound: 1-(2-fluorobenzenesulfonyl)-N-[2-(pyridin-2-yl)ethyl]-2,3-dihydro-1H-indole-6-carboxamide

P094-1969 Screening compound: 1-(2-fluorobenzenesulfonyl)-N-[2-(pyridin-2-yl)ethyl]-2,3-dihydro-1H-indole-6-carboxamide
P094-1969 Screening compound: 1-(2-fluorobenzenesulfonyl)-N-[2-(pyridin-2-yl)ethyl]-2,3-dihydro-1H-indole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P094-1969
1-(2-fluorobenzenesulfonyl)-N-[2-(pyridin-2-yl)ethyl]-2,3-dihydro-1H-indole-6-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

P094-1969

Molecular Formula

C22H20FN3O3S (C22 H20 FN3 O3 S)

Compound Name

1-(2-fluorobenzenesulfonyl)-N-[2-(pyridin-2-yl)ethyl]-2,3-dihydro-1H-indole-6-carboxamide

IUPAC name

1-(2-fluorobenzenesulfonyl)-N-[2-(pyridin-2-yl)ethyl]-23-dihydro-1H-indole-6-carboxamide

SMILES

O=C(c1cc(N(CC2)S(c(cccc3)c3F)(=O)=O)c2cc1)NCCc1ncccc1

InChI

InChI=1S/C22H20FN3O3S/c23-19-6-1-2-7-21(19)30(28,29)26-14-11-16-8-9-17(15-20(16)26)22(27)25-13-10-18-5-3-4-12-24-18/h1-9,12,15H,10-11,13-14H2,(H,25,27)

InChI Key

XPKSBKHBIAQEGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27564177

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.513

Distribution Coefficient, logD

2.513

Water Solubility, LogSw

-3.00

Polar Surface Area

65.555

Acid Dissociation Constant (pKa)

13.40

Base Dissociation Constant (pKb)

4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

P094-1969 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Digestive system
  • Nervous system
Targets:
  • GPCR
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P094-1969 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P094-1969?
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What is the minimum amount of P094-1969 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P094-1969
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P094-1969
  • 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 P094-1969 available by request