L589-2931 Screening compound: {1-[(1-ETHYL-1H-INDOL-3-YL)METHYL]-4-PIPERIDYL}[4-(2-FLUOROPHENYL)PIPERAZINO]METHANONE

L589-2931 Screening compound: {1-[(1-ETHYL-1H-INDOL-3-YL)METHYL]-4-PIPERIDYL}[4-(2-FLUOROPHENYL)PIPERAZINO]METHANONE
L589-2931 Screening compound: {1-[(1-ETHYL-1H-INDOL-3-YL)METHYL]-4-PIPERIDYL}[4-(2-FLUOROPHENYL)PIPERAZINO]METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound L589-2931
{1-[(1-ETHYL-1H-INDOL-3-YL)METHYL]-4-PIPERIDYL}[4-(2-FLUOROPHENYL)PIPERAZINO]METHANONE

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

L589-2931

Molecular Formula

C27H33FN4O (C27 H33 FN4 O)

Compound Name

{1-[(1-ETHYL-1H-INDOL-3-YL)METHYL]-4-PIPERIDYL}[4-(2-FLUOROPHENYL)PIPERAZINO]METHANONE

IUPAC name

1-ethyl-3-({4-[4-(2-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}methyl)-1H-indole

SMILES

CCn1c(cccc2)c2c(CN(CC2)CCC2C(N(CC2)CCN2c(cccc2)c2F)=O)c1

InChI

InChI=1S/C27H33FN4O/c1-2-30-20-22(23-7-3-5-9-25(23)30)19-29-13-11-21(12-14-29)27(33)32-17-15-31(16-18-32)26-10-6-4-8-24(26)28/h3-10,20-21H,2,11-19H2,1H3

InChI Key

BPFYCLNIVYOQFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27464347

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.58

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.964

Distribution Coefficient, logD

-1.917

Water Solubility, LogSw

-3.81

Polar Surface Area

25.307

Acid Dissociation Constant (pKa)

23.93

Base Dissociation Constant (pKb)

13.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.44

L589-2931 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • Cyclic compounds
Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L589-2931 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L589-2931?
Check Price and Availability of L589-2931, 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 L589-2931 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L589-2931
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L589-2931
  • 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 L589-2931 available by request