E022-1323 Screening compound: N-(2-ethylphenyl)-4-(3-oxo-2,3-dihydro-1,2-benzothiazol-2-yl)butanamide

E022-1323 Screening compound: N-(2-ethylphenyl)-4-(3-oxo-2,3-dihydro-1,2-benzothiazol-2-yl)butanamide
E022-1323 Screening compound: N-(2-ethylphenyl)-4-(3-oxo-2,3-dihydro-1,2-benzothiazol-2-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E022-1323
N-(2-ethylphenyl)-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

E022-1323

Molecular Formula

C19H20N2O2S (C19 H20 N2 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CCc(cccc1)c1NC(CCCN1Sc(cccc2)c2C1=O)=O

InChI

InChI=1S/C19H20N2O2S/c1-2-14-8-3-5-10-16(14)20-18(22)12-7-13-21-19(23)15-9-4-6-11-17(15)24-21/h3-6,8-11H,2,7,12-13H2,1H3,(H,20,22)

InChI Key

AMJCOTRXFOIJJS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14840688

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.755

Distribution Coefficient, logD

2.755

Water Solubility, LogSw

-3.38

Polar Surface Area

40.057

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

E022-1323 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 E022-1323 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E022-1323?
Check Price and Availability of E022-1323, 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 E022-1323 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E022-1323
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E022-1323
  • 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 E022-1323 available by request