D289-0424 Screening compound: 9-ethyl-6-{2-[4-(4-fluorophenyl)piperazino]-2-oxoethyl}-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione

D289-0424 Screening compound: 9-ethyl-6-{2-[4-(4-fluorophenyl)piperazino]-2-oxoethyl}-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione
D289-0424 Screening compound: 9-ethyl-6-{2-[4-(4-fluorophenyl)piperazino]-2-oxoethyl}-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D289-0424
9-ethyl-6-{2-[4-(4-fluorophenyl)piperazino]-2-oxoethyl}-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione

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

D289-0424

Molecular Formula

C26H26FN3O3S (C26 H26 FN3 O3 S)

Compound Name

9-ethyl-6-{2-[4-(4-fluorophenyl)piperazino]-2-oxoethyl}-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione

IUPAC name

13-ethyl-9-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-8lambda6-thia-9-azatricyclo[8.4.0.0^{27}]tetradeca-1(10)2(7)351113-hexaene-88-dione

SMILES

CCc(cc1)cc(-c2c3cccc2)c1N(CC(N(CC1)CCN1c(cc1)ccc1F)=O)S3(=O)=O

InChI

InChI=1S/C26H26FN3O3S/c1-2-19-7-12-24-23(17-19)22-5-3-4-6-25(22)34(32,33)30(24)18-26(31)29-15-13-28(14-16-29)21-10-8-20(27)9-11-21/h3-12,17H,2,13-16,18H2,1H3

InChI Key

FFPWUTVOHNIASZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09219187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.426

Distribution Coefficient, logD

4.426

Water Solubility, LogSw

-4.27

Polar Surface Area

50.415

Acid Dissociation Constant (pKa)

19.94

Base Dissociation Constant (pKb)

5.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

D289-0424 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D289-0424 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D289-0424?
Check Price and Availability of D289-0424, 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 D289-0424 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D289-0424
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D289-0424
  • 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 D289-0424 available by request