F223-0438 Screening compound: N-(6-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1,3-benzothiazol-2-yl)acetamide

F223-0438 Screening compound: N-(6-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1,3-benzothiazol-2-yl)acetamide
F223-0438 Screening compound: N-(6-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1,3-benzothiazol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F223-0438
N-(6-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1,3-benzothiazol-2-yl)acetamide

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

F223-0438

Molecular Formula

C20H21N5O2S (C20 H21 N5 O2 S)

Compound Name

N-(6-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1,3-benzothiazol-2-yl)acetamide

IUPAC name

N-(6-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-13-benzothiazol-2-yl)acetamide

SMILES

CC(Nc1nc(ccc(CC(N(CC2)CCN2c2ncccc2)=O)c2)c2s1)=O

InChI

InChI=1S/C20H21N5O2S/c1-14(26)22-20-23-16-6-5-15(12-17(16)28-20)13-19(27)25-10-8-24(9-11-25)18-4-2-3-7-21-18/h2-7,12H,8-11,13H2,1H3,(H,22,23,26)

InChI Key

LSCBQXMGXUKKCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14945169

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.920

Distribution Coefficient, logD

2.911

Water Solubility, LogSw

-3.19

Polar Surface Area

61.154

Acid Dissociation Constant (pKa)

11.75

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

F223-0438 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with F223-0438 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F223-0438?
Check Price and Availability of F223-0438, 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 F223-0438 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F223-0438
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F223-0438
  • 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 F223-0438 available by request