P094-1938 Screening compound: 1-(2-fluorobenzenesulfonyl)-N-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-indole-6-carboxamide

P094-1938 Screening compound: 1-(2-fluorobenzenesulfonyl)-N-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-indole-6-carboxamide
P094-1938 Screening compound: 1-(2-fluorobenzenesulfonyl)-N-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-indole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P094-1938
1-(2-fluorobenzenesulfonyl)-N-(1-methylpiperidin-4-yl)-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

P094-1938

Molecular Formula

C21H24FN3O3S (C21 H24 FN3 O3 S)

Compound Name

1-(2-fluorobenzenesulfonyl)-N-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-indole-6-carboxamide

IUPAC name

1-(2-fluorobenzenesulfonyl)-N-(1-methylpiperidin-4-yl)-23-dihydro-1H-indole-6-carboxamide

SMILES

CN(CC1)CCC1NC(c1cc(N(CC2)S(c(cccc3)c3F)(=O)=O)c2cc1)=O

InChI

InChI=1S/C21H24FN3O3S/c1-24-11-9-17(10-12-24)23-21(26)16-7-6-15-8-13-25(19(15)14-16)29(27,28)20-5-3-2-4-18(20)22/h2-7,14,17H,8-13H2,1H3,(H,23,26)

InChI Key

GKRMLOPZMFSHOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27564171

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.919

Distribution Coefficient, logD

-0.499

Water Solubility, LogSw

-2.76

Polar Surface Area

59.372

Acid Dissociation Constant (pKa)

15.03

Base Dissociation Constant (pKb)

9.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

P094-1938 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P094-1938 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P094-1938?
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What is the minimum amount of P094-1938 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P094-1938
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P094-1938
  • 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 P094-1938 available by request