D349-3699 Screening compound: 1-(2H-1,3-benzodioxol-5-yl)-4-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]piperazine

D349-3699 Screening compound: 1-(2H-1,3-benzodioxol-5-yl)-4-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]piperazine
D349-3699 Screening compound: 1-(2H-1,3-benzodioxol-5-yl)-4-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D349-3699
1-(2H-1,3-benzodioxol-5-yl)-4-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]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

D349-3699

Molecular Formula

C24H21N5O3 (C24 H21 N5 O3)

Compound Name

1-(2H-1,3-benzodioxol-5-yl)-4-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]piperazine

IUPAC name

1-(2H-13-benzodioxol-5-yl)-4-[3-(3-phenyl-124-oxadiazol-5-yl)pyridin-2-yl]piperazine

SMILES

C1Oc(cc(cc2)N(CC3)CCN3c(nccc3)c3-c3nc(-c4ccccc4)no3)c2O1

InChI

InChI=1S/C24H21N5O3/c1-2-5-17(6-3-1)22-26-24(32-27-22)19-7-4-10-25-23(19)29-13-11-28(12-14-29)18-8-9-20-21(15-18)31-16-30-20/h1-10,15H,11-14,16H2

InChI Key

ZJIFGYRANQOUDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14821785

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

427.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.919

Distribution Coefficient, logD

4.906

Water Solubility, LogSw

-4.83

Polar Surface Area

64.453

Acid Dissociation Constant (pKa)

23.50

Base Dissociation Constant (pKb)

5.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

D349-3699 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

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

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with D349-3699 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D349-3699?
Check Price and Availability of D349-3699, 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 D349-3699 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D349-3699
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D349-3699
  • 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 D349-3699 available by request