V028-8020 Screening compound: 2-[(2H-1,3-benzodioxol-5-yl)formamido]-2-[1-(4-chlorobenzoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide

V028-8020 Screening compound: 2-[(2H-1,3-benzodioxol-5-yl)formamido]-2-[1-(4-chlorobenzoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide
V028-8020 Screening compound: 2-[(2H-1,3-benzodioxol-5-yl)formamido]-2-[1-(4-chlorobenzoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-8020
2-[(2H-1,3-benzodioxol-5-yl)formamido]-2-[1-(4-chlorobenzoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide

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

V028-8020

Molecular Formula

C25H26ClN3O5 (C25 H26 ClN3 O5)

Compound Name

2-[(2H-1,3-benzodioxol-5-yl)formamido]-2-[1-(4-chlorobenzoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide

IUPAC name

2-[(2H-13-benzodioxol-5-yl)formamido]-2-[1-(4-chlorobenzoyl)piperidin-4-yl]-N-(prop-2-en-1-yl)acetamide

SMILES

C=CCNC(C(C(CC1)CCN1C(c(cc1)ccc1Cl)=O)NC(c(cc1)cc2c1OCO2)=O)=O

InChI

InChI=1S/C25H26ClN3O5/c1-2-11-27-24(31)22(28-23(30)18-5-8-20-21(14-18)34-15-33-20)16-9-12-29(13-10-16)25(32)17-3-6-19(26)7-4-17/h2-8,14,16,22H,1,9-13,15H2,(H,27,31)(H,28,30)/t22-/m0/s1

InChI Key

VYMCWOQYHOZCSR-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19875180

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.95

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.961

Distribution Coefficient, logD

2.961

Water Solubility, LogSw

-3.70

Polar Surface Area

82.294

Acid Dissociation Constant (pKa)

12.85

Base Dissociation Constant (pKb)

0.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.00

V028-8020 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V028-8020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-8020?
Check Price and Availability of V028-8020, 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 V028-8020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-8020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-8020
  • 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 V028-8020 available by request