V008-2692 Screening compound: N-(2-{[(2,6-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide

V008-2692 Screening compound: N-(2-{[(2,6-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide
V008-2692 Screening compound: N-(2-{[(2,6-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-2692
N-(2-{[(2,6-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(3,4,5-trimethoxyphenyl)quinoline-4-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

V008-2692

Molecular Formula

C28H26Cl2N2O4S (C28 H26 Cl2 N2 O4 S)

Compound Name

N-(2-{[(2,6-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide

IUPAC name

N-(2-{[(26-dichlorophenyl)methyl]sulfanyl}ethyl)-2-(345-trimethoxyphenyl)quinoline-4-carboxamide

SMILES

COc1cc(-c2nc3ccccc3c(C(NCCSCc(c(Cl)ccc3)c3Cl)=O)c2)cc(OC)c1OC

InChI

InChI=1S/C28H26Cl2N2O4S/c1-34-25-13-17(14-26(35-2)27(25)36-3)24-15-19(18-7-4-5-10-23(18)32-24)28(33)31-11-12-37-16-20-21(29)8-6-9-22(20)30/h4-10,13-15H,11-12,16H2,1-3H3,(H,31,33)

InChI Key

VRKYZPFSBFHABY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19961096

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

557.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.862

Distribution Coefficient, logD

6.833

Water Solubility, LogSw

-6.34

Polar Surface Area

55.530

Acid Dissociation Constant (pKa)

15.34

Base Dissociation Constant (pKb)

6.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

V008-2692 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V008-2692 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-2692?
Check Price and Availability of V008-2692, 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 V008-2692 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-2692
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-2692
  • 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 V008-2692 available by request