D101-0157 Screening compound: 3-fluoro-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide

D101-0157 Screening compound: 3-fluoro-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide
D101-0157 Screening compound: 3-fluoro-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D101-0157
3-fluoro-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-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

D101-0157

Molecular Formula

C17H14FN3O3 (C17 H14 FN3 O3)

Compound Name

3-fluoro-N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}benzamide

IUPAC name

3-fluoro-N-{[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]methyl}benzamide

SMILES

COc(cc1)ccc1-c1noc(CNC(c2cccc(F)c2)=O)n1

InChI

InChI=1S/C17H14FN3O3/c1-23-14-7-5-11(6-8-14)16-20-15(24-21-16)10-19-17(22)12-3-2-4-13(18)9-12/h2-9H,10H2,1H3,(H,19,22)

InChI Key

WPPXKCDDOBXTQE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06635464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.31

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

3.488

Distribution Coefficient, logD

3.488

Water Solubility, LogSw

-3.83

Polar Surface Area

63.539

Acid Dissociation Constant (pKa)

10.89

Base Dissociation Constant (pKb)

-6.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

References: we are preparing a list of scientific research reports with D101-0157 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D101-0157?
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What is the minimum amount of D101-0157 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D101-0157
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D101-0157
  • 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 D101-0157 available by request