V021-3278 Screening compound: N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-(2-methylpiperidin-1-yl)-2-oxoethyl}benzamide

V021-3278 Screening compound: N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-(2-methylpiperidin-1-yl)-2-oxoethyl}benzamide
V021-3278 Screening compound: N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-(2-methylpiperidin-1-yl)-2-oxoethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-3278
N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-(2-methylpiperidin-1-yl)-2-oxoethyl}benzamide

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

V021-3278

Molecular Formula

C23H34N4O2S (C23 H34 N4 O2 S)

Compound Name

N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-(2-methylpiperidin-1-yl)-2-oxoethyl}benzamide

IUPAC name

N-{1-[1-(ethylcarbamothioyl)piperidin-4-yl]-2-(2-methylpiperidin-1-yl)-2-oxoethyl}benzamide

SMILES

CCNC(N(CC1)CCC1C(C(N1C(C)CCCC1)=O)NC(c1ccccc1)=O)=S

InChI

InChI=1S/C23H34N4O2S/c1-3-24-23(30)26-15-12-18(13-16-26)20(22(29)27-14-8-7-9-17(27)2)25-21(28)19-10-5-4-6-11-19/h4-6,10-11,17-18,20H,3,7-9,12-16H2,1-2H3,(H,24,30)(H,25,28)

InChI Key

PNHXICKXOULLOE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19875960

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.61

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.872

Distribution Coefficient, logD

2.872

Water Solubility, LogSw

-3.28

Polar Surface Area

52.055

Acid Dissociation Constant (pKa)

11.24

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

60.90

V021-3278 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with V021-3278 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-3278?
Check Price and Availability of V021-3278, 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 V021-3278 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-3278
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-3278
  • 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 V021-3278 available by request