G642-0146 Screening compound: 1-(2-{[1,1'-biphenyl]-4-yl}-2-methyl-5-(2-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl)ethan-1-one

G642-0146 Screening compound: 1-(2-{[1,1'-biphenyl]-4-yl}-2-methyl-5-(2-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl)ethan-1-one
G642-0146 Screening compound: 1-(2-{[1,1'-biphenyl]-4-yl}-2-methyl-5-(2-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G642-0146
1-(2-{[1,1'-biphenyl]-4-yl}-2-methyl-5-(2-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl)ethan-1-one

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

G642-0146

Molecular Formula

C23H19N3O4 (C23 H19 N3 O4)

Compound Name

1-(2-{[1,1'-biphenyl]-4-yl}-2-methyl-5-(2-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-3-yl)ethan-1-one

IUPAC name

1-(2-{[11'-biphenyl]-4-yl}-2-methyl-5-(2-nitrophenyl)-23-dihydro-134-oxadiazol-3-yl)ethan-1-one

SMILES

CC1(c(cc2)ccc2-c2ccccc2)OC(c(cccc2)c2[N+]([O-])=O)=NN1C(C)=O

InChI

InChI=1S/C23H19N3O4/c1-16(27)25-23(2,19-14-12-18(13-15-19)17-8-4-3-5-9-17)30-22(24-25)20-10-6-7-11-21(20)26(28)29/h3-15H,1-2H3/t23-/m0/s1

InChI Key

HSSAFPYFIMXNSF-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD15025041

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.662

Distribution Coefficient, logD

4.662

Water Solubility, LogSw

-4.61

Polar Surface Area

67.191

Acid Dissociation Constant (pKa)

24.41

Base Dissociation Constant (pKb)

-1.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with G642-0146 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G642-0146?
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What is the minimum amount of G642-0146 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G642-0146
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G642-0146
  • 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 G642-0146 available by request