V009-5880 Screening compound: N-butyl-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide

V009-5880 Screening compound: N-butyl-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide
V009-5880 Screening compound: N-butyl-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-5880
N-butyl-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide

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

V009-5880

Molecular Formula

C25H27F3N4O (C25 H27 F3 N4 O)

Compound Name

N-butyl-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide

IUPAC name

N-butyl-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide

SMILES

CCCCNC(c1cc(N(CC2)CCN2c2cccc(C(F)(F)F)c2)nc2ccccc12)=O

InChI

InChI=1S/C25H27F3N4O/c1-2-3-11-29-24(33)21-17-23(30-22-10-5-4-9-20(21)22)32-14-12-31(13-15-32)19-8-6-7-18(16-19)25(26,27)28/h4-10,16-17H,2-3,11-15H2,1H3,(H,29,33)

InChI Key

PEDLEGMCQYKQQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19953089

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

456.51

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.293

Distribution Coefficient, logD

6.293

Water Solubility, LogSw

-5.76

Polar Surface Area

39.272

Acid Dissociation Constant (pKa)

16.77

Base Dissociation Constant (pKb)

3.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with V009-5880 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-5880?
Check Price and Availability of V009-5880, 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 V009-5880 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-5880
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-5880
  • 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 V009-5880 available by request