V021-6146 Screening compound: 1-({1-[3-(trifluoromethyl)benzoyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)piperidine

V021-6146 Screening compound: 1-({1-[3-(trifluoromethyl)benzoyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)piperidine
V021-6146 Screening compound: 1-({1-[3-(trifluoromethyl)benzoyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-6146
1-({1-[3-(trifluoromethyl)benzoyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)piperidine

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

V021-6146

Molecular Formula

C25H26F6N2O (C25 H26 F6 N2 O)

Compound Name

1-({1-[3-(trifluoromethyl)benzoyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)piperidine

IUPAC name

1-({1-[3-(trifluoromethyl)benzoyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)piperidine

SMILES

O=C(c1cccc(C(F)(F)F)c1)N(CC1CN2CCCCC2)CC1c1cc(C(F)(F)F)ccc1

InChI

InChI=1S/C25H26F6N2O/c26-24(27,28)20-8-4-6-17(12-20)22-16-33(15-19(22)14-32-10-2-1-3-11-32)23(34)18-7-5-9-21(13-18)25(29,30)31/h4-9,12-13,19,22H,1-3,10-11,14-16H2

InChI Key

AQQOPJFNVBBJMU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19922105

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

484.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.454

Distribution Coefficient, logD

2.823

Water Solubility, LogSw

-5.75

Polar Surface Area

20.581

Acid Dissociation Constant (pKa)

23.81

Base Dissociation Constant (pKb)

10.03

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

48.00

V021-6146 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with V021-6146 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-6146?
Check Price and Availability of V021-6146, 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 V021-6146 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-6146
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-6146
  • 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 V021-6146 available by request