V021-9047 Screening compound: 1-[(2,6-DIFLUOROPHENYL)METHYL]-3'-(THIOPHENE-2-CARBONYL)-1,2-DIHYDROSPIRO[INDOLE-3,2'-[1,3]THIAZOLIDIN]-2-ONE

V021-9047 Screening compound: 1-[(2,6-DIFLUOROPHENYL)METHYL]-3'-(THIOPHENE-2-CARBONYL)-1,2-DIHYDROSPIRO[INDOLE-3,2'-[1,3]THIAZOLIDIN]-2-ONE
V021-9047 Screening compound: 1-[(2,6-DIFLUOROPHENYL)METHYL]-3'-(THIOPHENE-2-CARBONYL)-1,2-DIHYDROSPIRO[INDOLE-3,2'-[1,3]THIAZOLIDIN]-2-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-9047
1-[(2,6-DIFLUOROPHENYL)METHYL]-3'-(THIOPHENE-2-CARBONYL)-1,2-DIHYDROSPIRO[INDOLE-3,2'-[1,3]THIAZOLIDIN]-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

V021-9047

Molecular Formula

C22H16F2N2O2S2 (C22 H16 F2 N2 O2 S2)

Compound Name

1-[(2,6-DIFLUOROPHENYL)METHYL]-3'-(THIOPHENE-2-CARBONYL)-1,2-DIHYDROSPIRO[INDOLE-3,2'-[1,3]THIAZOLIDIN]-2-ONE

IUPAC name

n/a

SMILES

O=C(c1cccs1)N1C(c(cccc2)c2N2Cc(c(F)ccc3)c3F)(C2=O)SCC1

InChI

InChI=1S/C22H16F2N2O2S2/c23-16-6-3-7-17(24)14(16)13-25-18-8-2-1-5-15(18)22(21(25)28)26(10-12-30-22)20(27)19-9-4-11-29-19/h1-9,11H,10,12-13H2/t22-/m0/s1

InChI Key

AJTKTVUGSNODMX-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19872257

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.397

Distribution Coefficient, logD

4.397

Water Solubility, LogSw

-4.48

Polar Surface Area

32.598

Acid Dissociation Constant (pKa)

27.43

Base Dissociation Constant (pKb)

-3.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.20

V021-9047 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V021-9047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-9047?
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What is the minimum amount of V021-9047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-9047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-9047
  • 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 V021-9047 available by request