V022-6455 Screening compound: N-(butan-2-yl)-3-(4-fluorophenyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide

V022-6455 Screening compound: N-(butan-2-yl)-3-(4-fluorophenyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide
V022-6455 Screening compound: N-(butan-2-yl)-3-(4-fluorophenyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-6455
N-(butan-2-yl)-3-(4-fluorophenyl)-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

V022-6455

Molecular Formula

C23H28FN3O (C23 H28 FN3 O)

Compound Name

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

IUPAC name

N-(butan-2-yl)-3-(4-fluorophenyl)-1H2H3H4H4aH5H6H-pyrazino[12-a]quinoline-5-carboxamide

SMILES

CCC(C)NC(C(C1)C(CN(CC2)c(cc3)ccc3F)N2c2c1cccc2)=O

InChI

InChI=1S/C23H28FN3O/c1-3-16(2)25-23(28)20-14-17-6-4-5-7-21(17)27-13-12-26(15-22(20)27)19-10-8-18(24)9-11-19/h4-11,16,20,22H,3,12-15H2,1-2H3,(H,25,28)

InChI Key

IFJDTIMXZJASHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19847580

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

381.49

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.275

Distribution Coefficient, logD

4.275

Water Solubility, LogSw

-4.05

Polar Surface Area

29.930

Acid Dissociation Constant (pKa)

14.48

Base Dissociation Constant (pKb)

7.81

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with V022-6455 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-6455?
Check Price and Availability of V022-6455, 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 V022-6455 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-6455
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-6455
  • 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 V022-6455 available by request