L258-0357 Screening compound: 1-(3,4-dimethylphenyl)-3-{2-[1-(4-fluorobenzenesulfonyl)piperidin-4-yl]ethyl}urea

L258-0357 Screening compound: 1-(3,4-dimethylphenyl)-3-{2-[1-(4-fluorobenzenesulfonyl)piperidin-4-yl]ethyl}urea
L258-0357 Screening compound: 1-(3,4-dimethylphenyl)-3-{2-[1-(4-fluorobenzenesulfonyl)piperidin-4-yl]ethyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L258-0357
1-(3,4-dimethylphenyl)-3-{2-[1-(4-fluorobenzenesulfonyl)piperidin-4-yl]ethyl}urea

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

L258-0357

Molecular Formula

C22H28FN3O3S (C22 H28 FN3 O3 S)

Compound Name

1-(3,4-dimethylphenyl)-3-{2-[1-(4-fluorobenzenesulfonyl)piperidin-4-yl]ethyl}urea

IUPAC name

1-(34-dimethylphenyl)-3-{2-[1-(4-fluorobenzenesulfonyl)piperidin-4-yl]ethyl}urea

SMILES

Cc(cc1)c(C)cc1NC(NCCC(CC1)CCN1S(c(cc1)ccc1F)(=O)=O)=O

InChI

InChI=1S/C22H28FN3O3S/c1-16-3-6-20(15-17(16)2)25-22(27)24-12-9-18-10-13-26(14-11-18)30(28,29)21-7-4-19(23)5-8-21/h3-8,15,18H,9-14H2,1-2H3,(H2,24,25,27)

InChI Key

KDXKPUIBGRSJQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27238503

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.744

Distribution Coefficient, logD

4.744

Water Solubility, LogSw

-4.46

Polar Surface Area

65.416

Acid Dissociation Constant (pKa)

13.88

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

L258-0357 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds
  • Mimetics

References: we are preparing a list of scientific research reports with L258-0357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L258-0357?
Check Price and Availability of L258-0357, 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 L258-0357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L258-0357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L258-0357
  • 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 L258-0357 available by request