P738-0017 Screening compound: 1-[1-(3-chlorobenzoyl)piperidin-4-yl]-2,3-dihydro-1H-indole

P738-0017 Screening compound: 1-[1-(3-chlorobenzoyl)piperidin-4-yl]-2,3-dihydro-1H-indole
P738-0017 Screening compound: 1-[1-(3-chlorobenzoyl)piperidin-4-yl]-2,3-dihydro-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound P738-0017
1-[1-(3-chlorobenzoyl)piperidin-4-yl]-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

P738-0017

Molecular Formula

C20H21ClN2O (C20 H21 ClN2 O)

Compound Name

1-[1-(3-chlorobenzoyl)piperidin-4-yl]-2,3-dihydro-1H-indole

IUPAC name

1-[1-(3-chlorobenzoyl)piperidin-4-yl]-23-dihydro-1H-indole

SMILES

O=C(c1cccc(Cl)c1)N(CC1)CCC1N(CC1)c2c1cccc2

InChI

InChI=1S/C20H21ClN2O/c21-17-6-3-5-16(14-17)20(24)22-11-9-18(10-12-22)23-13-8-15-4-1-2-7-19(15)23/h1-7,14,18H,8-13H2

InChI Key

PAWMFJUEQUEPDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27614138

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.85

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.156

Distribution Coefficient, logD

4.081

Water Solubility, LogSw

-4.49

Polar Surface Area

19.011

Acid Dissociation Constant (pKa)

25.87

Base Dissociation Constant (pKb)

8.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

P738-0017 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P738-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P738-0017?
Check Price and Availability of P738-0017, 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 P738-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P738-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P738-0017
  • 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 P738-0017 available by request