V002-2606 Screening compound: 1-[(3-cyanophenyl)methyl]-N-(3,4-dimethylphenyl)-5-methoxy-2-oxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidine]-3'-carboxamide

V002-2606 Screening compound: 1-[(3-cyanophenyl)methyl]-N-(3,4-dimethylphenyl)-5-methoxy-2-oxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidine]-3'-carboxamide
V002-2606 Screening compound: 1-[(3-cyanophenyl)methyl]-N-(3,4-dimethylphenyl)-5-methoxy-2-oxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidine]-3'-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-2606
1-[(3-cyanophenyl)methyl]-N-(3,4-dimethylphenyl)-5-methoxy-2-oxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidine]-3'-carboxamide

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

V002-2606

Molecular Formula

C28H26N4O3S (C28 H26 N4 O3 S)

Compound Name

1-[(3-cyanophenyl)methyl]-N-(3,4-dimethylphenyl)-5-methoxy-2-oxo-1,2-dihydrospiro[indole-3,2'-[1,3]thiazolidine]-3'-carboxamide

IUPAC name

1-[(3-cyanophenyl)methyl]-N-(34-dimethylphenyl)-5-methoxy-2-oxo-12-dihydrospiro[indole-32'-[13]thiazolidine]-3'-carboxamide

SMILES

Cc(cc1)c(C)cc1NC(N1C(c(cc(cc2)OC)c2N2Cc3cc(C#N)ccc3)(C2=O)SCC1)=O

InChI

InChI=1S/C28H26N4O3S/c1-18-7-8-22(13-19(18)2)30-27(34)32-11-12-36-28(32)24-15-23(35-3)9-10-25(24)31(26(28)33)17-21-6-4-5-20(14-21)16-29/h4-10,13-15H,11-12,17H2,1-3H3,(H,30,34)/t28-/m0/s1

InChI Key

NAUUBVTULPHJJW-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD19871774

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.540

Distribution Coefficient, logD

5.540

Water Solubility, LogSw

-5.40

Polar Surface Area

65.000

Acid Dissociation Constant (pKa)

14.57

Base Dissociation Constant (pKb)

-0.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

V002-2606 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V002-2606 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-2606?
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What is the minimum amount of V002-2606 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-2606
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-2606
  • 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 V002-2606 available by request