L126-0848 Screening compound: 3-(4-methoxyphenyl)-N~1~-[2-(piperazinosulfonyl)ethyl]-N~1~-[3-(1-pyrrolidinyl)propyl]propanamide

L126-0848 Screening compound: 3-(4-methoxyphenyl)-N~1~-[2-(piperazinosulfonyl)ethyl]-N~1~-[3-(1-pyrrolidinyl)propyl]propanamide
L126-0848 Screening compound: 3-(4-methoxyphenyl)-N~1~-[2-(piperazinosulfonyl)ethyl]-N~1~-[3-(1-pyrrolidinyl)propyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L126-0848
3-(4-methoxyphenyl)-N~1~-[2-(piperazinosulfonyl)ethyl]-N~1~-[3-(1-pyrrolidinyl)propyl]propanamide

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

L126-0848

Molecular Formula

C23H38N4O4S (C23 H38 N4 O4 S)

Compound Name

3-(4-methoxyphenyl)-N~1~-[2-(piperazinosulfonyl)ethyl]-N~1~-[3-(1-pyrrolidinyl)propyl]propanamide

IUPAC name

n/a

SMILES

COc1ccc(CCC(N(CCCN2CCCC2)CCS(N2CCNCC2)(=O)=O)=O)cc1

InChI

InChI=1S/C23H38N4O4S/c1-31-22-8-5-21(6-9-22)7-10-23(28)26(16-4-15-25-13-2-3-14-25)19-20-32(29,30)27-17-11-24-12-18-27/h5-6,8-9,24H,2-4,7,10-20H2,1H3

InChI Key

RBMWKJOYOYOMDQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27234291

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

466.65

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.903

Distribution Coefficient, logD

-1.855

Water Solubility, LogSw

-2.19

Polar Surface Area

71.337

Acid Dissociation Constant (pKa)

22.12

Base Dissociation Constant (pKb)

10.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

69.60

L126-0848 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L126-0848 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L126-0848?
Check Price and Availability of L126-0848, 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 L126-0848 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L126-0848
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L126-0848
  • 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 L126-0848 available by request