L501-0549 Screening compound: 1-{[4-(5-ethyl-1,2,4-oxadiazol-3-yl)thiophen-2-yl]sulfonyl}-N-(3-fluoro-4-methylphenyl)piperidine-3-carboxamide

L501-0549 Screening compound: 1-{[4-(5-ethyl-1,2,4-oxadiazol-3-yl)thiophen-2-yl]sulfonyl}-N-(3-fluoro-4-methylphenyl)piperidine-3-carboxamide
L501-0549 Screening compound: 1-{[4-(5-ethyl-1,2,4-oxadiazol-3-yl)thiophen-2-yl]sulfonyl}-N-(3-fluoro-4-methylphenyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L501-0549
1-{[4-(5-ethyl-1,2,4-oxadiazol-3-yl)thiophen-2-yl]sulfonyl}-N-(3-fluoro-4-methylphenyl)piperidine-3-carboxamide

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

L501-0549

Molecular Formula

C21H23FN4O4S2 (C21 H23 FN4 O4 S2)

Compound Name

1-{[4-(5-ethyl-1,2,4-oxadiazol-3-yl)thiophen-2-yl]sulfonyl}-N-(3-fluoro-4-methylphenyl)piperidine-3-carboxamide

IUPAC name

1-{[4-(5-ethyl-124-oxadiazol-3-yl)thiophen-2-yl]sulfonyl}-N-(3-fluoro-4-methylphenyl)piperidine-3-carboxamide

SMILES

CCc1nc(-c2csc(S(N(CCC3)CC3C(Nc3cc(F)c(C)cc3)=O)(=O)=O)c2)no1

InChI

InChI=1S/C21H23FN4O4S2/c1-3-18-24-20(25-30-18)15-9-19(31-12-15)32(28,29)26-8-4-5-14(11-26)21(27)23-16-7-6-13(2)17(22)10-16/h6-7,9-10,12,14H,3-5,8,11H2,1-2H3,(H,23,27)/t14-/m0/s1

InChI Key

XCTTUPMVUKPUPO-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27458784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.57

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.974

Distribution Coefficient, logD

3.970

Water Solubility, LogSw

-3.90

Polar Surface Area

87.335

Acid Dissociation Constant (pKa)

9.45

Base Dissociation Constant (pKb)

-0.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

L501-0549 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

SmartTM Library (51161 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Epigenetic
  • Epigenetic
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Targets:
  • Others
  • Kinases

References: we are preparing a list of scientific research reports with L501-0549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L501-0549?
Check Price and Availability of L501-0549, 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 L501-0549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L501-0549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L501-0549
  • 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 L501-0549 available by request