E628-1064 Screening compound: 2-ethyl-N-(3-fluoro-4-methylphenyl)-3,4-dihydro-2H-1,4-benzothiazine-4-carboxamide

E628-1064 Screening compound: 2-ethyl-N-(3-fluoro-4-methylphenyl)-3,4-dihydro-2H-1,4-benzothiazine-4-carboxamide
E628-1064 Screening compound: 2-ethyl-N-(3-fluoro-4-methylphenyl)-3,4-dihydro-2H-1,4-benzothiazine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E628-1064
2-ethyl-N-(3-fluoro-4-methylphenyl)-3,4-dihydro-2H-1,4-benzothiazine-4-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

E628-1064

Molecular Formula

C18H19FN2OS (C18 H19 FN2 OS)

Compound Name

2-ethyl-N-(3-fluoro-4-methylphenyl)-3,4-dihydro-2H-1,4-benzothiazine-4-carboxamide

IUPAC name

2-ethyl-N-(3-fluoro-4-methylphenyl)-34-dihydro-2H-14-benzothiazine-4-carboxamide

SMILES

CCC(C1)Sc(cccc2)c2N1C(Nc1cc(F)c(C)cc1)=O

InChI

InChI=1S/C18H19FN2OS/c1-3-14-11-21(16-6-4-5-7-17(16)23-14)18(22)20-13-9-8-12(2)15(19)10-13/h4-10,14H,3,11H2,1-2H3,(H,20,22)/t14-/m0/s1

InChI Key

NDUSSPHRTIFZGR-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD14905296

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.407

Distribution Coefficient, logD

5.407

Water Solubility, LogSw

-5.25

Polar Surface Area

24.305

Acid Dissociation Constant (pKa)

12.44

Base Dissociation Constant (pKb)

-0.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.80

E628-1064 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E628-1064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E628-1064?
Check Price and Availability of E628-1064, 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 E628-1064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E628-1064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E628-1064
  • 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 E628-1064 available by request