Y020-2896 Screening compound: 1-(7-methoxy-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one

Y020-2896 Screening compound: 1-(7-methoxy-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one
Y020-2896 Screening compound: 1-(7-methoxy-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-2896
1-(7-methoxy-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl)-2-(pyrimidin-2-ylsulfanyl)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

Y020-2896

Molecular Formula

C19H23N3O2S (C19 H23 N3 O2 S)

Compound Name

1-(7-methoxy-2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one

IUPAC name

1-(7-methoxy-224-trimethyl-1234-tetrahydroquinolin-1-yl)-2-(pyrimidin-2-ylsulfanyl)ethan-1-one

SMILES

CC(CC1(C)C)c(ccc(OC)c2)c2N1C(CSc1ncccn1)=O

InChI

InChI=1S/C19H23N3O2S/c1-13-11-19(2,3)22(16-10-14(24-4)6-7-15(13)16)17(23)12-25-18-20-8-5-9-21-18/h5-10,13H,11-12H2,1-4H3/t13-/m1/s1

InChI Key

VDQAFUUCRRNXLZ-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD11082788

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.357

Distribution Coefficient, logD

3.357

Water Solubility, LogSw

-3.63

Polar Surface Area

39.498

Acid Dissociation Constant (pKa)

17.42

Base Dissociation Constant (pKb)

3.91

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.10

Y020-2896 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 Y020-2896 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-2896?
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What is the minimum amount of Y020-2896 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-2896
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-2896
  • 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 Y020-2896 available by request