L581-0234 Screening compound: 1-(3-{[(4-fluorophenyl)sulfonyl]amino}benzoyl)-N-isobutyl-3-piperidinecarboxamide

L581-0234 Screening compound: 1-(3-{[(4-fluorophenyl)sulfonyl]amino}benzoyl)-N-isobutyl-3-piperidinecarboxamide
L581-0234 Screening compound: 1-(3-{[(4-fluorophenyl)sulfonyl]amino}benzoyl)-N-isobutyl-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L581-0234
1-(3-{[(4-fluorophenyl)sulfonyl]amino}benzoyl)-N-isobutyl-3-piperidinecarboxamide

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

L581-0234

Molecular Formula

C23H28FN3O4S (C23 H28 FN3 O4 S)

Compound Name

1-(3-{[(4-fluorophenyl)sulfonyl]amino}benzoyl)-N-isobutyl-3-piperidinecarboxamide

IUPAC name

1-[3-(4-fluorobenzenesulfonamido)benzoyl]-N-(2-methylpropyl)piperidine-3-carboxamide

SMILES

CC(C)CNC(C(CCC1)CN1C(c1cccc(NS(c(cc2)ccc2F)(=O)=O)c1)=O)=O

InChI

InChI=1S/C23H28FN3O4S/c1-16(2)14-25-22(28)18-6-4-12-27(15-18)23(29)17-5-3-7-20(13-17)26-32(30,31)21-10-8-19(24)9-11-21/h3,5,7-11,13,16,18,26H,4,6,12,14-15H2,1-2H3,(H,25,28)/t18-/m0/s1

InChI Key

IXYANCGUKCROTN-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27463751

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.096

Distribution Coefficient, logD

3.076

Water Solubility, LogSw

-3.56

Polar Surface Area

82.155

Acid Dissociation Constant (pKa)

8.73

Base Dissociation Constant (pKb)

0.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.13

L581-0234 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with L581-0234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L581-0234?
Check Price and Availability of L581-0234, 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 L581-0234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L581-0234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L581-0234
  • 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 L581-0234 available by request