L498-0506 Screening compound: 4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]benzamide

L498-0506 Screening compound: 4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]benzamide
L498-0506 Screening compound: 4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L498-0506
4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]benzamide

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

L498-0506

Molecular Formula

C20H18FN3O3 (C20 H18 FN3 O3)

Compound Name

4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]benzamide

IUPAC name

4-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]-N-[(oxolan-2-yl)methyl]benzamide

SMILES

O=C(c(cc1)ccc1-c1nc(-c(cc2)ccc2F)no1)NCC1OCCC1

InChI

InChI=1S/C20H18FN3O3/c21-16-9-7-13(8-10-16)18-23-20(27-24-18)15-5-3-14(4-6-15)19(25)22-12-17-2-1-11-26-17/h3-10,17H,1-2,11-12H2,(H,22,25)

InChI Key

GPFFSJAFKOXHKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15128809

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.288

Distribution Coefficient, logD

3.288

Water Solubility, LogSw

-3.45

Polar Surface Area

64.712

Acid Dissociation Constant (pKa)

12.97

Base Dissociation Constant (pKb)

-3.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

L498-0506 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with L498-0506 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L498-0506?
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What is the minimum amount of L498-0506 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L498-0506
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L498-0506
  • 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 L498-0506 available by request