P800-0133 Screening compound: 3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-phenyl-2,3-dihydro-1,3-oxazol-2-one

P800-0133 Screening compound: 3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-phenyl-2,3-dihydro-1,3-oxazol-2-one
P800-0133 Screening compound: 3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-phenyl-2,3-dihydro-1,3-oxazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P800-0133
3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-phenyl-2,3-dihydro-1,3-oxazol-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

P800-0133

Molecular Formula

C21H20FN3O3 (C21 H20 FN3 O3)

Compound Name

3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-phenyl-2,3-dihydro-1,3-oxazol-2-one

IUPAC name

3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-phenyl-23-dihydro-13-oxazol-2-one

SMILES

O=C(CN(C=C(c1ccccc1)O1)C1=O)N(CC1)CCN1c(cc1)ccc1F

InChI

InChI=1S/C21H20FN3O3/c22-17-6-8-18(9-7-17)23-10-12-24(13-11-23)20(26)15-25-14-19(28-21(25)27)16-4-2-1-3-5-16/h1-9,14H,10-13,15H2

InChI Key

UKNVNUSSCAVNAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27642410

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.538

Distribution Coefficient, logD

2.538

Water Solubility, LogSw

-2.61

Polar Surface Area

45.064

Acid Dissociation Constant (pKa)

25.75

Base Dissociation Constant (pKb)

5.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

P800-0133 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 P800-0133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P800-0133?
Check Price and Availability of P800-0133, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of P800-0133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P800-0133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P800-0133
  • 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 P800-0133 available by request