V002-9109 Screening compound: 1-(2-ethoxyethyl)-3-[1-(4-pentylbenzenesulfonyl)piperidin-4-yl]-1H-indole

V002-9109 Screening compound: 1-(2-ethoxyethyl)-3-[1-(4-pentylbenzenesulfonyl)piperidin-4-yl]-1H-indole
V002-9109 Screening compound: 1-(2-ethoxyethyl)-3-[1-(4-pentylbenzenesulfonyl)piperidin-4-yl]-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-9109
1-(2-ethoxyethyl)-3-[1-(4-pentylbenzenesulfonyl)piperidin-4-yl]-1H-indole

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

V002-9109

Molecular Formula

C28H38N2O3S (C28 H38 N2 O3 S)

Compound Name

1-(2-ethoxyethyl)-3-[1-(4-pentylbenzenesulfonyl)piperidin-4-yl]-1H-indole

IUPAC name

1-(2-ethoxyethyl)-3-[1-(4-pentylbenzenesulfonyl)piperidin-4-yl]-1H-indole

SMILES

CCCCCc(cc1)ccc1S(N(CC1)CCC1c1cn(CCOCC)c2c1cccc2)(=O)=O

InChI

InChI=1S/C28H38N2O3S/c1-3-5-6-9-23-12-14-25(15-13-23)34(31,32)30-18-16-24(17-19-30)27-22-29(20-21-33-4-2)28-11-8-7-10-26(27)28/h7-8,10-15,22,24H,3-6,9,16-21H2,1-2H3

InChI Key

YPPSHITYVMCHBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19952234

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.69

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.713

Distribution Coefficient, logD

6.713

Water Solubility, LogSw

-5.99

Polar Surface Area

41.637

Acid Dissociation Constant (pKa)

24.95

Base Dissociation Constant (pKb)

-2.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

V002-9109 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V002-9109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-9109?
Check Price and Availability of V002-9109, 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 V002-9109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-9109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-9109
  • 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 V002-9109 available by request