Y040-4782 Screening compound: 2-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]-1-[4-(2-fluorophenyl)piperazin-1-yl]ethan-1-one

Y040-4782 Screening compound: 2-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]-1-[4-(2-fluorophenyl)piperazin-1-yl]ethan-1-one
Y040-4782 Screening compound: 2-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]-1-[4-(2-fluorophenyl)piperazin-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4782
2-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]-1-[4-(2-fluorophenyl)piperazin-1-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

Y040-4782

Molecular Formula

C21H19F2N3OS (C21 H19 F2 N3 OS)

Compound Name

2-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]-1-[4-(2-fluorophenyl)piperazin-1-yl]ethan-1-one

IUPAC name

2-[2-(2-fluorophenyl)-13-thiazol-4-yl]-1-[4-(2-fluorophenyl)piperazin-1-yl]ethan-1-one

SMILES

O=C(Cc1csc(-c(cccc2)c2F)n1)N(CC1)CCN1c(cccc1)c1F

InChI

InChI=1S/C21H19F2N3OS/c22-17-6-2-1-5-16(17)21-24-15(14-28-21)13-20(27)26-11-9-25(10-12-26)19-8-4-3-7-18(19)23/h1-8,14H,9-13H2

InChI Key

OLTOXURTGWTJIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10042083

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.408

Distribution Coefficient, logD

4.408

Water Solubility, LogSw

-4.54

Polar Surface Area

29.548

Acid Dissociation Constant (pKa)

20.99

Base Dissociation Constant (pKb)

2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

Y040-4782 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y040-4782 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4782?
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What is the minimum amount of Y040-4782 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4782
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4782
  • 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 Y040-4782 available by request