G574-0052 Screening compound: 3,4,5-triethoxy-N-{2-[2-(thiophen-2-yl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-yl]ethyl}benzamide

G574-0052 Screening compound: 3,4,5-triethoxy-N-{2-[2-(thiophen-2-yl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-yl]ethyl}benzamide
G574-0052 Screening compound: 3,4,5-triethoxy-N-{2-[2-(thiophen-2-yl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-yl]ethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G574-0052
3,4,5-triethoxy-N-{2-[2-(thiophen-2-yl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-yl]ethyl}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

G574-0052

Molecular Formula

C23H26N4O4S2 (C23 H26 N4 O4 S2)

Compound Name

3,4,5-triethoxy-N-{2-[2-(thiophen-2-yl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-yl]ethyl}benzamide

IUPAC name

345-triethoxy-N-{2-[2-(thiophen-2-yl)-[124]triazolo[32-b][13]thiazol-6-yl]ethyl}benzamide

SMILES

CCOc1cc(C(NCCc2csc3nc(-c4cccs4)nn23)=O)cc(OCC)c1OCC

InChI

InChI=1S/C23H26N4O4S2/c1-4-29-17-12-15(13-18(30-5-2)20(17)31-6-3)22(28)24-10-9-16-14-33-23-25-21(26-27(16)23)19-8-7-11-32-19/h7-8,11-14H,4-6,9-10H2,1-3H3,(H,24,28)

InChI Key

DHNJDYGPKYGLOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08009833

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.983

Distribution Coefficient, logD

3.983

Water Solubility, LogSw

-4.03

Polar Surface Area

68.433

Acid Dissociation Constant (pKa)

14.86

Base Dissociation Constant (pKb)

1.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

G574-0052 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G574-0052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G574-0052?
Check Price and Availability of G574-0052, 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 G574-0052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G574-0052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G574-0052
  • 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 G574-0052 available by request