D341-1993 Screening compound: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-ethylbutanamide

D341-1993 Screening compound: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-ethylbutanamide
D341-1993 Screening compound: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-ethylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D341-1993
N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-ethylbutanamide

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

D341-1993

Molecular Formula

C19H20N2OS (C19 H20 N2 OS)

Compound Name

N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-ethylbutanamide

IUPAC name

N-[3-(13-benzothiazol-2-yl)phenyl]-2-ethylbutanamide

SMILES

CCC(CC)C(Nc1cccc(-c2nc(cccc3)c3s2)c1)=O

InChI

InChI=1S/C19H20N2OS/c1-3-13(4-2)18(22)20-15-9-7-8-14(12-15)19-21-16-10-5-6-11-17(16)23-19/h5-13H,3-4H2,1-2H3,(H,20,22)

InChI Key

BTHJSNREEQWFKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08550740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.315

Distribution Coefficient, logD

5.315

Water Solubility, LogSw

-5.23

Polar Surface Area

33.050

Acid Dissociation Constant (pKa)

12.58

Base Dissociation Constant (pKb)

1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

D341-1993 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D341-1993 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D341-1993?
Check Price and Availability of D341-1993, 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 D341-1993 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D341-1993
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D341-1993
  • 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 D341-1993 available by request