V015-5468 Screening compound: 2-{[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl]oxy}-1-[4-(1-methyl-1H-indol-3-yl)piperidino]-1-ethanone

V015-5468 Screening compound: 2-{[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl]oxy}-1-[4-(1-methyl-1H-indol-3-yl)piperidino]-1-ethanone
V015-5468 Screening compound: 2-{[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl]oxy}-1-[4-(1-methyl-1H-indol-3-yl)piperidino]-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-5468
2-{[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl]oxy}-1-[4-(1-methyl-1H-indol-3-yl)piperidino]-1-ethanone

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

V015-5468

Molecular Formula

C26H38N2O2 (C26 H38 N2 O2)

Compound Name

2-{[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl]oxy}-1-[4-(1-methyl-1H-indol-3-yl)piperidino]-1-ethanone

IUPAC name

1-[4-(1-methyl-1H-indol-3-yl)piperidin-1-yl]-2-{[(1R2S5R)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}ethan-1-one

SMILES

CC(C)[C@H](CC[C@@H](C)C1)[C@@H]1OCC(N(CC1)CCC1c1cn(C)c2c1cccc2)=O

InChI

InChI=1S/C26H38N2O2/c1-18(2)21-10-9-19(3)15-25(21)30-17-26(29)28-13-11-20(12-14-28)23-16-27(4)24-8-6-5-7-22(23)24/h5-8,16,18-21,25H,9-15,17H2,1-4H3/t19-,21-,25+/m0/s1

InChI Key

QGGPTQFGTXNBIR-QYXIYQDXSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.6

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.521

Distribution Coefficient, logD

5.521

Water Solubility, LogSw

-5.51

Polar Surface Area

25.795

Acid Dissociation Constant (pKa)

22.74

Base Dissociation Constant (pKb)

-0.67

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

65.39

V015-5468 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

DGK Inhibitors Library (10558 compounds)

GPCR Targeted Library (31838 compounds)

Indole Derivatives (10091 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • Kinases
  • GPCR
Mechanism of action:
  • Receptor's ligands
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V015-5468 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-5468?
Check Price and Availability of V015-5468, 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 V015-5468 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-5468
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-5468
  • 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 V015-5468 available by request