Y020-4394 Screening compound: 2,2,4-trimethyl-1-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroquinolin-6-ol

Y020-4394 Screening compound: 2,2,4-trimethyl-1-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroquinolin-6-ol
Y020-4394 Screening compound: 2,2,4-trimethyl-1-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroquinolin-6-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-4394
2,2,4-trimethyl-1-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroquinolin-6-ol

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

Y020-4394

Molecular Formula

C17H19NO2S (C17 H19 NO2 S)

Compound Name

2,2,4-trimethyl-1-(thiophene-2-carbonyl)-1,2,3,4-tetrahydroquinolin-6-ol

IUPAC name

224-trimethyl-1-(thiophene-2-carbonyl)-1234-tetrahydroquinolin-6-ol

SMILES

CC(CC1(C)C)c(cc(cc2)O)c2N1C(c1cccs1)=O

InChI

InChI=1S/C17H19NO2S/c1-11-10-17(2,3)18(16(20)15-5-4-8-21-15)14-7-6-12(19)9-13(11)14/h4-9,11,19H,10H2,1-3H3/t11-/m1/s1

InChI Key

JGGGFEKHDVEXIB-LLVKDONJSA-N

MDL Number (MFCD)

MFCD18204553

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.473

Distribution Coefficient, logD

3.473

Water Solubility, LogSw

-3.68

Polar Surface Area

32.959

Acid Dissociation Constant (pKa)

11.32

Base Dissociation Constant (pKb)

4.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.30

Y020-4394 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y020-4394 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-4394?
Check Price and Availability of Y020-4394, 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 Y020-4394 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-4394
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-4394
  • 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 Y020-4394 available by request