Y020-9974 Screening compound: 4,4,8-trimethyl-5-(naphthalene-1-carbonyl)-1H,4H,5H-[1,2]dithiolo[3,4-c]quinoline-1-thione

Y020-9974 Screening compound: 4,4,8-trimethyl-5-(naphthalene-1-carbonyl)-1H,4H,5H-[1,2]dithiolo[3,4-c]quinoline-1-thione
Y020-9974 Screening compound: 4,4,8-trimethyl-5-(naphthalene-1-carbonyl)-1H,4H,5H-[1,2]dithiolo[3,4-c]quinoline-1-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-9974
4,4,8-trimethyl-5-(naphthalene-1-carbonyl)-1H,4H,5H-[1,2]dithiolo[3,4-c]quinoline-1-thione

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

Y020-9974

Molecular Formula

C24H19NOS3 (C24 H19 NOS3)

Compound Name

4,4,8-trimethyl-5-(naphthalene-1-carbonyl)-1H,4H,5H-[1,2]dithiolo[3,4-c]quinoline-1-thione

IUPAC name

448-trimethyl-5-(naphthalene-1-carbonyl)-1H4H5H-[12]dithiolo[34-c]quinoline-1-thione

SMILES

CC1(C)N(C(c2cccc3ccccc23)=O)c(ccc(C)c2)c2C2=C1SSC2=S

InChI

InChI=1S/C24H19NOS3/c1-14-11-12-19-18(13-14)20-21(28-29-23(20)27)24(2,3)25(19)22(26)17-10-6-8-15-7-4-5-9-16(15)17/h4-13H,1-3H3

InChI Key

AGJKNLXYFDPWHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00624684

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.62

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.914

Distribution Coefficient, logD

5.914

Water Solubility, LogSw

-6.64

Polar Surface Area

14.163

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-1.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

Y020-9974 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y020-9974 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-9974?
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What is the minimum amount of Y020-9974 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-9974
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-9974
  • 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 Y020-9974 available by request