V001-5863 Screening compound: 4-(2-methylpyrrolidine-1-carbonyl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline

V001-5863 Screening compound: 4-(2-methylpyrrolidine-1-carbonyl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline
V001-5863 Screening compound: 4-(2-methylpyrrolidine-1-carbonyl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-5863
4-(2-methylpyrrolidine-1-carbonyl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline

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

V001-5863

Molecular Formula

C26H27F3N4O (C26 H27 F3 N4 O)

Compound Name

4-(2-methylpyrrolidine-1-carbonyl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline

IUPAC name

4-(2-methylpyrrolidine-1-carbonyl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline

SMILES

CC(CCC1)N1C(c1cc(N(CC2)CCN2c2cccc(C(F)(F)F)c2)nc2ccccc12)=O

InChI

InChI=1S/C26H27F3N4O/c1-18-6-5-11-33(18)25(34)22-17-24(30-23-10-3-2-9-21(22)23)32-14-12-31(13-15-32)20-8-4-7-19(16-20)26(27,28)29/h2-4,7-10,16-18H,5-6,11-15H2,1H3/t18-/m0/s1

InChI Key

LAZJSROLZDERND-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19953090

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

468.52

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.689

Distribution Coefficient, logD

5.689

Water Solubility, LogSw

-5.83

Polar Surface Area

31.045

Acid Dissociation Constant (pKa)

24.01

Base Dissociation Constant (pKb)

4.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

V001-5863 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V001-5863 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-5863?
Check Price and Availability of V001-5863, 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 V001-5863 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-5863
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-5863
  • 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 V001-5863 available by request