E022-1362 Screening compound: N-(2-methoxyethyl)-4-(3-oxo-2,3-dihydro-1,2-benzothiazol-2-yl)butanamide

E022-1362 Screening compound: N-(2-methoxyethyl)-4-(3-oxo-2,3-dihydro-1,2-benzothiazol-2-yl)butanamide
E022-1362 Screening compound: N-(2-methoxyethyl)-4-(3-oxo-2,3-dihydro-1,2-benzothiazol-2-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E022-1362
N-(2-methoxyethyl)-4-(3-oxo-2,3-dihydro-1,2-benzothiazol-2-yl)butanamide

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

E022-1362

Molecular Formula

C14H18N2O3S (C14 H18 N2 O3 S)

Compound Name

N-(2-methoxyethyl)-4-(3-oxo-2,3-dihydro-1,2-benzothiazol-2-yl)butanamide

IUPAC name

N-(2-methoxyethyl)-4-(3-oxo-23-dihydro-12-benzothiazol-2-yl)butanamide

SMILES

COCCNC(CCCN1Sc(cccc2)c2C1=O)=O

InChI

InChI=1S/C14H18N2O3S/c1-19-10-8-15-13(17)7-4-9-16-14(18)11-5-2-3-6-12(11)20-16/h2-3,5-6H,4,7-10H2,1H3,(H,15,17)

InChI Key

AQQJPXOTDJZCDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14840704

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

294.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.290

Distribution Coefficient, logD

0.290

Water Solubility, LogSw

-2.12

Polar Surface Area

50.533

Acid Dissociation Constant (pKa)

14.46

Base Dissociation Constant (pKb)

4.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

E022-1362 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E022-1362 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E022-1362?
Check Price and Availability of E022-1362, 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 E022-1362 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E022-1362
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E022-1362
  • 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 E022-1362 available by request