F454-0182 Screening compound: 1-(2-ethylphenyl)-2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydro-3-quinolinecarbonitrile

F454-0182 Screening compound: 1-(2-ethylphenyl)-2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydro-3-quinolinecarbonitrile
F454-0182 Screening compound: 1-(2-ethylphenyl)-2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydro-3-quinolinecarbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound F454-0182
1-(2-ethylphenyl)-2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydro-3-quinolinecarbonitrile

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

F454-0182

Molecular Formula

C24H20N2O2 (C24 H20 N2 O2)

Compound Name

1-(2-ethylphenyl)-2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydro-3-quinolinecarbonitrile

IUPAC name

n/a

SMILES

CCc(cccc1)c1N(C(CC(C1)c2ccccc2)=C(C=C2C#N)C1=O)C2=O

InChI

InChI=1S/C24H20N2O2/c1-2-16-8-6-7-11-21(16)26-22-13-18(17-9-4-3-5-10-17)14-23(27)20(22)12-19(15-25)24(26)28/h3-12,18H,2,13-14H2,1H3/t18-/m0/s1

InChI Key

UFGXJRMPRMSYCQ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14954881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.178

Distribution Coefficient, logD

4.178

Water Solubility, LogSw

-4.17

Polar Surface Area

45.064

Acid Dissociation Constant (pKa)

19.25

Base Dissociation Constant (pKb)

-5.50

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.80

References: we are preparing a list of scientific research reports with F454-0182 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F454-0182?
Check Price and Availability of F454-0182, 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 F454-0182 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F454-0182
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F454-0182
  • 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 F454-0182 available by request