L529-0317 Screening compound: 2-{4'-fluoro-[1,1'-biphenyl]-4-sulfonamido}-3-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide

L529-0317 Screening compound: 2-{4'-fluoro-[1,1'-biphenyl]-4-sulfonamido}-3-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide
L529-0317 Screening compound: 2-{4'-fluoro-[1,1'-biphenyl]-4-sulfonamido}-3-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L529-0317
2-{4'-fluoro-[1,1'-biphenyl]-4-sulfonamido}-3-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide

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

L529-0317

Molecular Formula

C23H25FN2O4S (C23 H25 FN2 O4 S)

Compound Name

2-{4'-fluoro-[1,1'-biphenyl]-4-sulfonamido}-3-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide

IUPAC name

2-{4'-fluoro-[11'-biphenyl]-4-sulfonamido}-3-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide

SMILES

CC(C)C(C(NCc1ccc(C)o1)=O)NS(c(cc1)ccc1-c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C23H25FN2O4S/c1-15(2)22(23(27)25-14-20-11-4-16(3)30-20)26-31(28,29)21-12-7-18(8-13-21)17-5-9-19(24)10-6-17/h4-13,15,22,26H,14H2,1-3H3,(H,25,27)/t22-/m0/s1

InChI Key

DNMYDONADOJVMX-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD15129801

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.810

Distribution Coefficient, logD

4.809

Water Solubility, LogSw

-4.67

Polar Surface Area

73.238

Acid Dissociation Constant (pKa)

10.45

Base Dissociation Constant (pKb)

-2.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

L529-0317 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SH2 Library (10483 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L529-0317 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L529-0317?
Check Price and Availability of L529-0317, 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 L529-0317 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L529-0317
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L529-0317
  • 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 L529-0317 available by request