D079-0014 Screening compound: 1-(3-chlorophenyl)-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazine

D079-0014 Screening compound: 1-(3-chlorophenyl)-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazine
D079-0014 Screening compound: 1-(3-chlorophenyl)-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D079-0014
1-(3-chlorophenyl)-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazine

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

D079-0014

Molecular Formula

C19H19ClN4O (C19 H19 ClN4 O)

Compound Name

1-(3-chlorophenyl)-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]piperazine

IUPAC name

1-(3-chlorophenyl)-4-[(5-phenyl-134-oxadiazol-2-yl)methyl]piperazine

SMILES

Clc1cc(N2CCN(Cc3nnc(-c4ccccc4)o3)CC2)ccc1

InChI

InChI=1S/C19H19ClN4O/c20-16-7-4-8-17(13-16)24-11-9-23(10-12-24)14-18-21-22-19(25-18)15-5-2-1-3-6-15/h1-8,13H,9-12,14H2

InChI Key

VDSIEVGSPGDSNL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06643553

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.361

Distribution Coefficient, logD

3.361

Water Solubility, LogSw

-3.62

Polar Surface Area

37.413

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

3.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

D079-0014 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS Targets (44014 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D079-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D079-0014?
Check Price and Availability of D079-0014, 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 D079-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D079-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D079-0014
  • 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 D079-0014 available by request