V002-9119 Screening compound: 3-[1-(1-benzothiophene-2-carbonyl)piperidin-4-yl]-1-pentyl-1H-indole

V002-9119 Screening compound: 3-[1-(1-benzothiophene-2-carbonyl)piperidin-4-yl]-1-pentyl-1H-indole
V002-9119 Screening compound: 3-[1-(1-benzothiophene-2-carbonyl)piperidin-4-yl]-1-pentyl-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-9119
3-[1-(1-benzothiophene-2-carbonyl)piperidin-4-yl]-1-pentyl-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

V002-9119

Molecular Formula

C27H30N2OS (C27 H30 N2 OS)

Compound Name

3-[1-(1-benzothiophene-2-carbonyl)piperidin-4-yl]-1-pentyl-1H-indole

IUPAC name

3-[1-(1-benzothiophene-2-carbonyl)piperidin-4-yl]-1-pentyl-1H-indole

SMILES

CCCCCn1c(cccc2)c2c(C(CC2)CCN2C(c2cc(cccc3)c3s2)=O)c1

InChI

InChI=1S/C27H30N2OS/c1-2-3-8-15-29-19-23(22-10-5-6-11-24(22)29)20-13-16-28(17-14-20)27(30)26-18-21-9-4-7-12-25(21)31-26/h4-7,9-12,18-20H,2-3,8,13-17H2,1H3

InChI Key

HCQKKQRWKJWWBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19952147

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.61

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.070

Distribution Coefficient, logD

7.070

Water Solubility, LogSw

-6.52

Polar Surface Area

19.344

Acid Dissociation Constant (pKa)

24.94

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

V002-9119 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V002-9119 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-9119?
Check Price and Availability of V002-9119, 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 V002-9119 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-9119
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-9119
  • 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 V002-9119 available by request