8015-2201 Screening compound: 4-{4,4,6,8-tetramethyl-1-sulfanylidene-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinolin-2-yl}-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide

8015-2201 Screening compound: 4-{4,4,6,8-tetramethyl-1-sulfanylidene-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinolin-2-yl}-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide
8015-2201 Screening compound: 4-{4,4,6,8-tetramethyl-1-sulfanylidene-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinolin-2-yl}-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-2201
4-{4,4,6,8-tetramethyl-1-sulfanylidene-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinolin-2-yl}-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide

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

8015-2201

Molecular Formula

C23H22N4O2S4 (C23 H22 N4 O2 S4)

Compound Name

4-{4,4,6,8-tetramethyl-1-sulfanylidene-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinolin-2-yl}-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide

IUPAC name

4-{4468-tetramethyl-1-sulfanylidene-1H2H4H5H-[12]thiazolo[54-c]quinolin-2-yl}-N-(13-thiazol-2-yl)benzene-1-sulfonamide

SMILES

CC1(C)Nc(c(C)cc(C)c2)c2C(C2=S)=C1SN2c(cc1)ccc1S(Nc1nccs1)(=O)=O

InChI

InChI=1S/C23H22N4O2S4/c1-13-11-14(2)19-17(12-13)18-20(23(3,4)25-19)32-27(21(18)30)15-5-7-16(8-6-15)33(28,29)26-22-24-9-10-31-22/h5-12,25H,1-4H3,(H,24,26)

InChI Key

XWTWXIINBLZXPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03856083

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

514.72

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.045

Distribution Coefficient, logD

4.635

Water Solubility, LogSw

-4.68

Polar Surface Area

63.582

Acid Dissociation Constant (pKa)

7.20

Base Dissociation Constant (pKb)

-1.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

8015-2201 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Proteases
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8015-2201 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-2201?
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What is the minimum amount of 8015-2201 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-2201
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-2201
  • 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 8015-2201 available by request