V009-2011 Screening compound: 3-(2-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-8-(trifluoromethyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide

V009-2011 Screening compound: 3-(2-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-8-(trifluoromethyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide
V009-2011 Screening compound: 3-(2-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-8-(trifluoromethyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-2011
3-(2-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-8-(trifluoromethyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-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

V009-2011

Molecular Formula

C26H25F4N3OS (C26 H25 F4 N3 OS)

Compound Name

3-(2-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-8-(trifluoromethyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide

IUPAC name

3-(2-fluorophenyl)-N-[2-(thiophen-2-yl)ethyl]-8-(trifluoromethyl)-1H2H3H4H4aH5H6H-pyrazino[12-a]quinoline-5-carboxamide

SMILES

O=C(C(C1)C(CN(CC2)c(cccc3)c3F)N2c2c1cc(C(F)(F)F)cc2)NCCc1cccs1

InChI

InChI=1S/C26H25F4N3OS/c27-21-5-1-2-6-23(21)32-11-12-33-22-8-7-18(26(28,29)30)14-17(22)15-20(24(33)16-32)25(34)31-10-9-19-4-3-13-35-19/h1-8,13-14,20,24H,9-12,15-16H2,(H,31,34)

InChI Key

KCDGNJIJSQWMQU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19853213

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

503.56

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.277

Distribution Coefficient, logD

5.277

Water Solubility, LogSw

-5.50

Polar Surface Area

30.776

Acid Dissociation Constant (pKa)

13.26

Base Dissociation Constant (pKb)

6.76

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

34.60

V009-2011 in Drug Discovery

Included in Screening Libraries

Bromodomain Modulators Library (5801 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V009-2011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-2011?
Check Price and Availability of V009-2011, 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 V009-2011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-2011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-2011
  • 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 V009-2011 available by request