Y020-5549 Screening compound: 1-[4-(4-chlorophenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl]-2-(4-ethylphenoxy)ethan-1-one

Y020-5549 Screening compound: 1-[4-(4-chlorophenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl]-2-(4-ethylphenoxy)ethan-1-one
Y020-5549 Screening compound: 1-[4-(4-chlorophenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl]-2-(4-ethylphenoxy)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-5549
1-[4-(4-chlorophenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl]-2-(4-ethylphenoxy)ethan-1-one

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

Y020-5549

Molecular Formula

C28H30ClNO2 (C28 H30 ClNO2)

Compound Name

1-[4-(4-chlorophenyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl]-2-(4-ethylphenoxy)ethan-1-one

IUPAC name

1-[4-(4-chlorophenyl)-224-trimethyl-1234-tetrahydroquinolin-1-yl]-2-(4-ethylphenoxy)ethan-1-one

SMILES

CCc(cc1)ccc1OCC(N(C(C)(C)CC1(C)c(cc2)ccc2Cl)c2c1cccc2)=O

InChI

InChI=1S/C28H30ClNO2/c1-5-20-10-16-23(17-11-20)32-18-26(31)30-25-9-7-6-8-24(25)28(4,19-27(30,2)3)21-12-14-22(29)15-13-21/h6-17H,5,18-19H2,1-4H3/t28-/m0/s1

InChI Key

FOFXZXXFJVYFJG-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD03321623

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.916

Distribution Coefficient, logD

6.916

Water Solubility, LogSw

-6.21

Polar Surface Area

21.024

Acid Dissociation Constant (pKa)

24.81

Base Dissociation Constant (pKb)

0.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

32.10

Y020-5549 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y020-5549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-5549?
Check Price and Availability of Y020-5549, 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 Y020-5549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-5549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-5549
  • 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 Y020-5549 available by request