D420-4554 Screening compound: 2-(4-cyclopropanecarbonylpiperazin-1-yl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)quinoline

D420-4554 Screening compound: 2-(4-cyclopropanecarbonylpiperazin-1-yl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)quinoline
D420-4554 Screening compound: 2-(4-cyclopropanecarbonylpiperazin-1-yl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound D420-4554
2-(4-cyclopropanecarbonylpiperazin-1-yl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)quinoline

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

D420-4554

Molecular Formula

C20H21N5O2 (C20 H21 N5 O2)

Compound Name

2-(4-cyclopropanecarbonylpiperazin-1-yl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)quinoline

IUPAC name

2-(4-cyclopropanecarbonylpiperazin-1-yl)-3-(5-methyl-124-oxadiazol-3-yl)quinoline

SMILES

Cc1nc(-c2cc3ccccc3nc2N(CC2)CCN2C(C2CC2)=O)no1

InChI

InChI=1S/C20H21N5O2/c1-13-21-18(23-27-13)16-12-15-4-2-3-5-17(15)22-19(16)24-8-10-25(11-9-24)20(26)14-6-7-14/h2-5,12,14H,6-11H2,1H3

InChI Key

HFDFLQAJFCKNLJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14827979

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.435

Distribution Coefficient, logD

3.193

Water Solubility, LogSw

-3.73

Polar Surface Area

59.839

Acid Dissociation Constant (pKa)

22.91

Base Dissociation Constant (pKb)

7.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

D420-4554 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D420-4554 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D420-4554?
Check Price and Availability of D420-4554, 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 D420-4554 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D420-4554
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D420-4554
  • 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 D420-4554 available by request