D101-0318 Screening compound: N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-[1,1'-biphenyl]-4-carboxamide

D101-0318 Screening compound: N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-[1,1'-biphenyl]-4-carboxamide
D101-0318 Screening compound: N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-[1,1'-biphenyl]-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D101-0318
N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-[1,1'-biphenyl]-4-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

D101-0318

Molecular Formula

C22H17N3O2 (C22 H17 N3 O2)

Compound Name

N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-[1,1'-biphenyl]-4-carboxamide

IUPAC name

N-[(3-phenyl-124-oxadiazol-5-yl)methyl]-[11'-biphenyl]-4-carboxamide

SMILES

O=C(c(cc1)ccc1-c1ccccc1)NCc1nc(-c2ccccc2)no1

InChI

InChI=1S/C22H17N3O2/c26-22(19-13-11-17(12-14-19)16-7-3-1-4-8-16)23-15-20-24-21(25-27-20)18-9-5-2-6-10-18/h1-14H,15H2,(H,23,26)

InChI Key

VYRGVEWCNYPKJE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06633403

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.997

Distribution Coefficient, logD

4.997

Water Solubility, LogSw

-5.15

Polar Surface Area

55.723

Acid Dissociation Constant (pKa)

11.87

Base Dissociation Constant (pKb)

-6.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

D101-0318 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with D101-0318 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D101-0318?
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What is the minimum amount of D101-0318 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D101-0318
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D101-0318
  • 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 D101-0318 available by request