G025-0140 Screening compound: 3-(1,1-dioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)-N~1~-(4-fluorobenzyl)benzamide

G025-0140 Screening compound: 3-(1,1-dioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)-N~1~-(4-fluorobenzyl)benzamide
G025-0140 Screening compound: 3-(1,1-dioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)-N~1~-(4-fluorobenzyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G025-0140
3-(1,1-dioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)-N~1~-(4-fluorobenzyl)benzamide

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

G025-0140

Molecular Formula

C17H17FN2O3S (C17 H17 FN2 O3 S)

Compound Name

3-(1,1-dioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)-N~1~-(4-fluorobenzyl)benzamide

IUPAC name

3-(11-dioxo-1lambda62-thiazolidin-2-yl)-N-[(4-fluorophenyl)methyl]benzamide

SMILES

O=C(c1cccc(N(CCC2)S2(=O)=O)c1)NCc(cc1)ccc1F

InChI

InChI=1S/C17H17FN2O3S/c18-15-7-5-13(6-8-15)12-19-17(21)14-3-1-4-16(11-14)20-9-2-10-24(20,22)23/h1,3-8,11H,2,9-10,12H2,(H,19,21)

InChI Key

AIGZIBFZIKHYLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10515302

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.772

Distribution Coefficient, logD

1.772

Water Solubility, LogSw

-2.54

Polar Surface Area

56.687

Acid Dissociation Constant (pKa)

11.58

Base Dissociation Constant (pKb)

-4.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

G025-0140 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G025-0140 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G025-0140?
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What is the minimum amount of G025-0140 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G025-0140
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G025-0140
  • 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 G025-0140 available by request