D339-0520 Screening compound: 1-[2-(pyridin-4-yl)ethyl]-4-(3,4,5-trimethoxybenzoyl)piperazine

D339-0520 Screening compound: 1-[2-(pyridin-4-yl)ethyl]-4-(3,4,5-trimethoxybenzoyl)piperazine
D339-0520 Screening compound: 1-[2-(pyridin-4-yl)ethyl]-4-(3,4,5-trimethoxybenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D339-0520
1-[2-(pyridin-4-yl)ethyl]-4-(3,4,5-trimethoxybenzoyl)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

D339-0520

Molecular Formula

C21H27N3O4 (C21 H27 N3 O4)

Compound Name

1-[2-(pyridin-4-yl)ethyl]-4-(3,4,5-trimethoxybenzoyl)piperazine

IUPAC name

1-[2-(pyridin-4-yl)ethyl]-4-(345-trimethoxybenzoyl)piperazine

SMILES

COc1cc(C(N2CCN(CCc3ccncc3)CC2)=O)cc(OC)c1OC

InChI

InChI=1S/C21H27N3O4/c1-26-18-14-17(15-19(27-2)20(18)28-3)21(25)24-12-10-23(11-13-24)9-6-16-4-7-22-8-5-16/h4-5,7-8,14-15H,6,9-13H2,1-3H3

InChI Key

ZYKUTPFLNXBAQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12915871

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

385.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.033

Distribution Coefficient, logD

1.003

Water Solubility, LogSw

-1.65

Polar Surface Area

52.812

Acid Dissociation Constant (pKa)

27.29

Base Dissociation Constant (pKb)

6.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

D339-0520 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with D339-0520 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D339-0520?
Check Price and Availability of D339-0520, 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 D339-0520 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D339-0520
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D339-0520
  • 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 D339-0520 available by request