L126-0381 Screening compound: 4-bromo-N-pentyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide

L126-0381 Screening compound: 4-bromo-N-pentyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide
L126-0381 Screening compound: 4-bromo-N-pentyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L126-0381
4-bromo-N-pentyl-N-[2-(piperazine-1-sulfonyl)ethyl]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

L126-0381

Molecular Formula

C18H28BrN3O3S (C18 H28 BrN3 O3 S)

Compound Name

4-bromo-N-pentyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide

IUPAC name

4-bromo-N-pentyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide

SMILES

CCCCCN(CCS(N1CCNCC1)(=O)=O)C(c(cc1)ccc1Br)=O

InChI

InChI=1S/C18H28BrN3O3S/c1-2-3-4-11-21(18(23)16-5-7-17(19)8-6-16)14-15-26(24,25)22-12-9-20-10-13-22/h5-8,20H,2-4,9-15H2,1H3

InChI Key

MNEVJINIDGEAHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27234149

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

446.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.556

Distribution Coefficient, logD

2.211

Water Solubility, LogSw

-2.88

Polar Surface Area

60.244

Acid Dissociation Constant (pKa)

21.97

Base Dissociation Constant (pKb)

7.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.10

L126-0381 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with L126-0381 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L126-0381?
Check Price and Availability of L126-0381, 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 L126-0381 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L126-0381
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L126-0381
  • 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 L126-0381 available by request