E676-2526 Screening compound: N-[2-(dimethylamino)ethyl]-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-phenylacetamide

E676-2526 Screening compound: N-[2-(dimethylamino)ethyl]-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-phenylacetamide
E676-2526 Screening compound: N-[2-(dimethylamino)ethyl]-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E676-2526
N-[2-(dimethylamino)ethyl]-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-phenylacetamide

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

E676-2526

Molecular Formula

C21H25N3O2S (C21 H25 N3 O2 S)

Compound Name

N-[2-(dimethylamino)ethyl]-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-2-phenylacetamide

IUPAC name

N-[2-(dimethylamino)ethyl]-N-(4-methoxy-7-methyl-13-benzothiazol-2-yl)-2-phenylacetamide

SMILES

Cc(cc1)c2sc(N(CCN(C)C)C(Cc3ccccc3)=O)nc2c1OC

InChI

InChI=1S/C21H25N3O2S/c1-15-10-11-17(26-4)19-20(15)27-21(22-19)24(13-12-23(2)3)18(25)14-16-8-6-5-7-9-16/h5-11H,12-14H2,1-4H3

InChI Key

KGQZUIOJYUCWKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11985120

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

383.51

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

4.678

Distribution Coefficient, logD

3.890

Water Solubility, LogSw

-4.49

Polar Surface Area

37.114

Acid Dissociation Constant (pKa)

17.86

Base Dissociation Constant (pKb)

8.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

E676-2526 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS BBB Library (22607 compounds)

CORONAVIRUS Library (20774 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with E676-2526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E676-2526?
Check Price and Availability of E676-2526, 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 E676-2526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E676-2526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E676-2526
  • 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 E676-2526 available by request