V001-6836 Screening compound: 1-benzyl-5-chloro-3'-(2-fluorobenzoyl)-5',5'-dimethyl-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-2-one

V001-6836 Screening compound: 1-benzyl-5-chloro-3'-(2-fluorobenzoyl)-5',5'-dimethyl-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-2-one
V001-6836 Screening compound: 1-benzyl-5-chloro-3'-(2-fluorobenzoyl)-5',5'-dimethyl-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-6836
1-benzyl-5-chloro-3'-(2-fluorobenzoyl)-5',5'-dimethyl-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

V001-6836

Molecular Formula

C26H22ClFN2O2S (C26 H22 ClFN2 O2 S)

Compound Name

1-benzyl-5-chloro-3'-(2-fluorobenzoyl)-5',5'-dimethyl-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidin]-2-one

IUPAC name

1-benzyl-5-chloro-3'-(2-fluorobenzoyl)-5'5'-dimethyl-12-dihydrospiro[indole-32'-[13]thiazolidin]-2-one

SMILES

CC(C)(C1)SC(c(cc(cc2)Cl)c2N2Cc3ccccc3)(C2=O)N1C(c(cccc1)c1F)=O

InChI

InChI=1S/C26H22ClFN2O2S/c1-25(2)16-30(23(31)19-10-6-7-11-21(19)28)26(33-25)20-14-18(27)12-13-22(20)29(24(26)32)15-17-8-4-3-5-9-17/h3-14H,15-16H2,1-2H3/t26-/m0/s1

InChI Key

BODFTNBOVZABBP-SANMLTNESA-N

MDL Number (MFCD)

MFCD19870621

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.99

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

6.477

Distribution Coefficient, logD

6.477

Water Solubility, LogSw

-6.06

Polar Surface Area

31.513

Acid Dissociation Constant (pKa)

27.15

Base Dissociation Constant (pKb)

-4.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

V001-6836 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Library (67538 compounds)

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Nervous system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V001-6836 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-6836?
Check Price and Availability of V001-6836, 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 V001-6836 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-6836
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-6836
  • 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 V001-6836 available by request