E676-4861 Screening compound: N-[2-(DIETHYLAMINO)ETHYL]-N-(4,5-DIMETHYL-1,3-BENZOTHIAZOL-2-YL)FURAN-2-CARBOXAMIDE

E676-4861 Screening compound: N-[2-(DIETHYLAMINO)ETHYL]-N-(4,5-DIMETHYL-1,3-BENZOTHIAZOL-2-YL)FURAN-2-CARBOXAMIDE
E676-4861 Screening compound: N-[2-(DIETHYLAMINO)ETHYL]-N-(4,5-DIMETHYL-1,3-BENZOTHIAZOL-2-YL)FURAN-2-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound E676-4861
N-[2-(DIETHYLAMINO)ETHYL]-N-(4,5-DIMETHYL-1,3-BENZOTHIAZOL-2-YL)FURAN-2-CARBOXAMIDE

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

E676-4861

Molecular Formula

C20H25N3O2S (C20 H25 N3 O2 S)

Compound Name

N-[2-(DIETHYLAMINO)ETHYL]-N-(4,5-DIMETHYL-1,3-BENZOTHIAZOL-2-YL)FURAN-2-CARBOXAMIDE

IUPAC name

n/a

SMILES

CCN(CC)CCN(C(c1ccco1)=O)c1nc(c(C)c(C)cc2)c2s1

InChI

InChI=1S/C20H25N3O2S/c1-5-22(6-2)11-12-23(19(24)16-8-7-13-25-16)20-21-18-15(4)14(3)9-10-17(18)26-20/h7-10,13H,5-6,11-12H2,1-4H3

InChI Key

HOCPORRYAMNYSB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11985420

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

371.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.747

Distribution Coefficient, logD

4.121

Water Solubility, LogSw

-4.30

Polar Surface Area

38.135

Acid Dissociation Constant (pKa)

24.32

Base Dissociation Constant (pKb)

7.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

E676-4861 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Immune system
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Others
  • Kinases

References: we are preparing a list of scientific research reports with E676-4861 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E676-4861?
Check Price and Availability of E676-4861, 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 E676-4861 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E676-4861
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E676-4861
  • 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 E676-4861 available by request