V020-9045 Screening compound: cyclobutyl{3-[(2,5-difluorobenzyl)oxy]piperidino}methanone

V020-9045 Screening compound: cyclobutyl{3-[(2,5-difluorobenzyl)oxy]piperidino}methanone
V020-9045 Screening compound: cyclobutyl{3-[(2,5-difluorobenzyl)oxy]piperidino}methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-9045
cyclobutyl{3-[(2,5-difluorobenzyl)oxy]piperidino}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

V020-9045

Molecular Formula

C17H21F2NO2 (C17 H21 F2 NO2)

Compound Name

cyclobutyl{3-[(2,5-difluorobenzyl)oxy]piperidino}methanone

IUPAC name

1-cyclobutanecarbonyl-3-[(25-difluorophenyl)methoxy]piperidine

SMILES

O=C(C1CCC1)N(CCC1)CC1OCc(cc(cc1)F)c1F

InChI

InChI=1S/C17H21F2NO2/c18-14-6-7-16(19)13(9-14)11-22-15-5-2-8-20(10-15)17(21)12-3-1-4-12/h6-7,9,12,15H,1-5,8,10-11H2/t15-/m0/s1

InChI Key

UQZFDSYFISVUFP-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD19884581

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.751

Distribution Coefficient, logD

2.751

Water Solubility, LogSw

-2.84

Polar Surface Area

24.085

Acid Dissociation Constant (pKa)

23.62

Base Dissociation Constant (pKb)

-0.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.80

V020-9045 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V020-9045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-9045?
Check Price and Availability of V020-9045, 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 V020-9045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-9045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-9045
  • 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 V020-9045 available by request