P680-0137 Screening compound: 1-ethyl-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4-hydroxy-1,2-dihydroquinolin-2-one

P680-0137 Screening compound: 1-ethyl-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4-hydroxy-1,2-dihydroquinolin-2-one
P680-0137 Screening compound: 1-ethyl-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4-hydroxy-1,2-dihydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P680-0137
1-ethyl-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4-hydroxy-1,2-dihydroquinolin-2-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

P680-0137

Molecular Formula

C19H14FN3O3 (C19 H14 FN3 O3)

Compound Name

1-ethyl-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4-hydroxy-1,2-dihydroquinolin-2-one

IUPAC name

1-ethyl-3-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]-4-hydroxy-12-dihydroquinolin-2-one

SMILES

CCN(c(cccc1)c1C(O)=C1c2nc(-c(cc3)ccc3F)no2)C1=O

InChI

InChI=1S/C19H14FN3O3/c1-2-23-14-6-4-3-5-13(14)16(24)15(19(23)25)18-21-17(22-26-18)11-7-9-12(20)10-8-11/h3-10,24H,2H2,1H3

InChI Key

UJNFXLUAHCHQOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27611093

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.288

Distribution Coefficient, logD

-0.424

Water Solubility, LogSw

-3.59

Polar Surface Area

61.814

Acid Dissociation Constant (pKa)

3.69

Base Dissociation Constant (pKb)

-5.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

P680-0137 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P680-0137 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P680-0137?
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What is the minimum amount of P680-0137 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P680-0137
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P680-0137
  • 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 P680-0137 available by request