3341-1744 Screening compound: 4-methoxy-N~1~-[7-(methylsulfanyl)[1,3]thiazolo[4,5-g][1,3]benzothiazol-2-yl]benzamide

3341-1744 Screening compound: 4-methoxy-N~1~-[7-(methylsulfanyl)[1,3]thiazolo[4,5-g][1,3]benzothiazol-2-yl]benzamide
3341-1744 Screening compound: 4-methoxy-N~1~-[7-(methylsulfanyl)[1,3]thiazolo[4,5-g][1,3]benzothiazol-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3341-1744
4-methoxy-N~1~-[7-(methylsulfanyl)[1,3]thiazolo[4,5-g][1,3]benzothiazol-2-yl]benzamide

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

3341-1744

Molecular Formula

C17H13N3O2S3 (C17 H13 N3 O2 S3)

Compound Name

4-methoxy-N~1~-[7-(methylsulfanyl)[1,3]thiazolo[4,5-g][1,3]benzothiazol-2-yl]benzamide

IUPAC name

4-methoxy-N-[11-(methylsulfanyl)-312-dithia-510-diazatricyclo[7.3.0.0^{26}]dodeca-1(9)2(6)4710-pentaen-4-yl]benzamide

SMILES

COc(cc1)ccc1C(Nc1nc2ccc3nc(SC)sc3c2s1)=O

InChI

InChI=1S/C17H13N3O2S3/c1-22-10-5-3-9(4-6-10)15(21)20-16-18-11-7-8-12-14(13(11)24-16)25-17(19-12)23-2/h3-8H,1-2H3,(H,18,20,21)

InChI Key

SWIXOVKVVLBDPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04418993

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.367

Distribution Coefficient, logD

5.366

Water Solubility, LogSw

-5.44

Polar Surface Area

49.716

Acid Dissociation Constant (pKa)

10.21

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

3341-1744 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with 3341-1744 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3341-1744?
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What is the minimum amount of 3341-1744 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3341-1744
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3341-1744
  • 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 3341-1744 available by request