D345-0092 Screening compound: 1-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}butan-1-one

D345-0092 Screening compound: 1-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}butan-1-one
D345-0092 Screening compound: 1-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}butan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D345-0092
1-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}butan-1-one

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

D345-0092

Molecular Formula

C15H23N3O (C15 H23 N3 O)

Compound Name

1-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}butan-1-one

IUPAC name

1-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}butan-1-one

SMILES

CCCC(N1CCN(CCc2ncccc2)CC1)=O

InChI

InChI=1S/C15H23N3O/c1-2-5-15(19)18-12-10-17(11-13-18)9-7-14-6-3-4-8-16-14/h3-4,6,8H,2,5,7,9-13H2,1H3

InChI Key

AIRRFPYAEBFYRO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07454547

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

261.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.372

Distribution Coefficient, logD

1.328

Water Solubility, LogSw

-1.58

Polar Surface Area

29.693

Acid Dissociation Constant (pKa)

24.45

Base Dissociation Constant (pKb)

6.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

D345-0092 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D345-0092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D345-0092?
Check Price and Availability of D345-0092, 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 D345-0092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D345-0092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D345-0092
  • 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 D345-0092 available by request