V026-8964 Screening compound: N~1~-{2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolan-3-yl]ethyl}-N~1~-ethyl-3-fluorobenzamide

V026-8964 Screening compound: N~1~-{2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolan-3-yl]ethyl}-N~1~-ethyl-3-fluorobenzamide
V026-8964 Screening compound: N~1~-{2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolan-3-yl]ethyl}-N~1~-ethyl-3-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-8964
N~1~-{2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolan-3-yl]ethyl}-N~1~-ethyl-3-fluorobenzamide

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

V026-8964

Molecular Formula

C20H19F3N2O2S (C20 H19 F3 N2 O2 S)

Compound Name

N~1~-{2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolan-3-yl]ethyl}-N~1~-ethyl-3-fluorobenzamide

IUPAC name

n/a

SMILES

CCN(CCN(C(c(ccc(F)c1)c1F)SC1)C1=O)C(c1cc(F)ccc1)=O

InChI

InChI=1S/C20H19F3N2O2S/c1-2-24(19(27)13-4-3-5-14(21)10-13)8-9-25-18(26)12-28-20(25)16-7-6-15(22)11-17(16)23/h3-7,10-11,20H,2,8-9,12H2,1H3/t20-/m0/s1

InChI Key

WISYSPTYBOVTJP-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19793623

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.506

Distribution Coefficient, logD

3.506

Water Solubility, LogSw

-3.73

Polar Surface Area

32.909

Acid Dissociation Constant (pKa)

17.16

Base Dissociation Constant (pKb)

-2.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

V026-8964 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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 V026-8964 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-8964?
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What is the minimum amount of V026-8964 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-8964
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-8964
  • 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 V026-8964 available by request