P094-1709 Screening compound: 1-(benzenesulfonyl)-N-[2-(pyridin-4-yl)ethyl]-2,3-dihydro-1H-indole-6-carboxamide

P094-1709 Screening compound: 1-(benzenesulfonyl)-N-[2-(pyridin-4-yl)ethyl]-2,3-dihydro-1H-indole-6-carboxamide
P094-1709 Screening compound: 1-(benzenesulfonyl)-N-[2-(pyridin-4-yl)ethyl]-2,3-dihydro-1H-indole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P094-1709
1-(benzenesulfonyl)-N-[2-(pyridin-4-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

P094-1709

Molecular Formula

C22H21N3O3S (C22 H21 N3 O3 S)

Compound Name

1-(benzenesulfonyl)-N-[2-(pyridin-4-yl)ethyl]-2,3-dihydro-1H-indole-6-carboxamide

IUPAC name

1-(benzenesulfonyl)-N-[2-(pyridin-4-yl)ethyl]-23-dihydro-1H-indole-6-carboxamide

SMILES

O=C(c1cc(N(CC2)S(c3ccccc3)(=O)=O)c2cc1)NCCc1ccncc1

InChI

InChI=1S/C22H21N3O3S/c26-22(24-14-10-17-8-12-23-13-9-17)19-7-6-18-11-15-25(21(18)16-19)29(27,28)20-4-2-1-3-5-20/h1-9,12-13,16H,10-11,14-15H2,(H,24,26)

InChI Key

BJDVICXTBISYDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27564158

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.49

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

1.986

Distribution Coefficient, logD

1.941

Water Solubility, LogSw

-2.62

Polar Surface Area

65.440

Acid Dissociation Constant (pKa)

13.40

Base Dissociation Constant (pKb)

6.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

P094-1709 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with P094-1709 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P094-1709?
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What is the minimum amount of P094-1709 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P094-1709
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P094-1709
  • 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 P094-1709 available by request