D424-0061 Screening compound: 2-(4-benzylpiperidin-1-yl)-1-(5-methyl-1H-indol-3-yl)ethan-1-ol

D424-0061 Screening compound: 2-(4-benzylpiperidin-1-yl)-1-(5-methyl-1H-indol-3-yl)ethan-1-ol
D424-0061 Screening compound: 2-(4-benzylpiperidin-1-yl)-1-(5-methyl-1H-indol-3-yl)ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D424-0061
2-(4-benzylpiperidin-1-yl)-1-(5-methyl-1H-indol-3-yl)ethan-1-ol

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

D424-0061

Molecular Formula

C23H28N2O (C23 H28 N2 O)

Compound Name

2-(4-benzylpiperidin-1-yl)-1-(5-methyl-1H-indol-3-yl)ethan-1-ol

IUPAC name

2-(4-benzylpiperidin-1-yl)-1-(5-methyl-1H-indol-3-yl)ethan-1-ol

SMILES

Cc(cc1)cc2c1[nH]cc2C(CN1CCC(Cc2ccccc2)CC1)O

InChI

InChI=1S/C23H28N2O/c1-17-7-8-22-20(13-17)21(15-24-22)23(26)16-25-11-9-19(10-12-25)14-18-5-3-2-4-6-18/h2-8,13,15,19,23-24,26H,9-12,14,16H2,1H3/t23-/m0/s1

InChI Key

BFKMFCLYFYDDMF-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD27585282

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.49

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.769

Distribution Coefficient, logD

4.178

Water Solubility, LogSw

-4.53

Polar Surface Area

29.722

Acid Dissociation Constant (pKa)

14.15

Base Dissociation Constant (pKb)

7.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

D424-0061 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with D424-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D424-0061?
Check Price and Availability of D424-0061, 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 D424-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D424-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D424-0061
  • 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 D424-0061 available by request