V018-0688 Screening compound: 4-(2-{[1,1'-biphenyl]-4-yl}ethyl)-1-(2-methoxybenzoyl)piperidine

V018-0688 Screening compound: 4-(2-{[1,1'-biphenyl]-4-yl}ethyl)-1-(2-methoxybenzoyl)piperidine
V018-0688 Screening compound: 4-(2-{[1,1'-biphenyl]-4-yl}ethyl)-1-(2-methoxybenzoyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-0688
4-(2-{[1,1'-biphenyl]-4-yl}ethyl)-1-(2-methoxybenzoyl)piperidine

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

V018-0688

Molecular Formula

C27H29NO2 (C27 H29 NO2)

Compound Name

4-(2-{[1,1'-biphenyl]-4-yl}ethyl)-1-(2-methoxybenzoyl)piperidine

IUPAC name

4-(2-{[11'-biphenyl]-4-yl}ethyl)-1-(2-methoxybenzoyl)piperidine

SMILES

COc(cccc1)c1C(N1CCC(CCc(cc2)ccc2-c2ccccc2)CC1)=O

InChI

InChI=1S/C27H29NO2/c1-30-26-10-6-5-9-25(26)27(29)28-19-17-22(18-20-28)12-11-21-13-15-24(16-14-21)23-7-3-2-4-8-23/h2-10,13-16,22H,11-12,17-20H2,1H3

InChI Key

IYBUVAXHSIHRFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19948654

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.53

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.718

Distribution Coefficient, logD

5.718

Water Solubility, LogSw

-5.72

Polar Surface Area

23.974

Acid Dissociation Constant (pKa)

24.69

Base Dissociation Constant (pKb)

-1.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

V018-0688 in Drug Discovery

Included in Screening Libraries

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

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V018-0688 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-0688?
Check Price and Availability of V018-0688, 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 V018-0688 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-0688
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-0688
  • 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 V018-0688 available by request