V002-0030 Screening compound: 1-propyl-3-{1-[2-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-1H-indole

V002-0030 Screening compound: 1-propyl-3-{1-[2-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-1H-indole
V002-0030 Screening compound: 1-propyl-3-{1-[2-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-0030
1-propyl-3-{1-[2-(trifluoromethoxy)benzenesulfonyl]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

V002-0030

Molecular Formula

C23H25F3N2O3S (C23 H25 F3 N2 O3 S)

Compound Name

1-propyl-3-{1-[2-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-1H-indole

IUPAC name

1-propyl-3-{1-[2-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-1H-indole

SMILES

CCCn1c(cccc2)c2c(C(CC2)CCN2S(c(cccc2)c2OC(F)(F)F)(=O)=O)c1

InChI

InChI=1S/C23H25F3N2O3S/c1-2-13-27-16-19(18-7-3-4-8-20(18)27)17-11-14-28(15-12-17)32(29,30)22-10-6-5-9-21(22)31-23(24,25)26/h3-10,16-17H,2,11-15H2,1H3

InChI Key

NADARHSWJTZUKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19952163

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.742

Distribution Coefficient, logD

5.742

Water Solubility, LogSw

-5.78

Polar Surface Area

39.683

Acid Dissociation Constant (pKa)

24.95

Base Dissociation Constant (pKb)

-1.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

V002-0030 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 V002-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-0030?
Check Price and Availability of V002-0030, 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 V002-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-0030
  • 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 V002-0030 available by request