F222-0884 Screening compound: N-(6-{2-[(2,4-difluorophenyl)carbamoyl]ethyl}-1,3-benzothiazol-2-yl)-2-methylpropanamide

F222-0884 Screening compound: N-(6-{2-[(2,4-difluorophenyl)carbamoyl]ethyl}-1,3-benzothiazol-2-yl)-2-methylpropanamide
F222-0884 Screening compound: N-(6-{2-[(2,4-difluorophenyl)carbamoyl]ethyl}-1,3-benzothiazol-2-yl)-2-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F222-0884
N-(6-{2-[(2,4-difluorophenyl)carbamoyl]ethyl}-1,3-benzothiazol-2-yl)-2-methylpropanamide

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

F222-0884

Molecular Formula

C20H19F2N3O2S (C20 H19 F2 N3 O2 S)

Compound Name

N-(6-{2-[(2,4-difluorophenyl)carbamoyl]ethyl}-1,3-benzothiazol-2-yl)-2-methylpropanamide

IUPAC name

N-(6-{2-[(24-difluorophenyl)carbamoyl]ethyl}-13-benzothiazol-2-yl)-2-methylpropanamide

SMILES

CC(C)C(Nc1nc(ccc(CCC(Nc(ccc(F)c2)c2F)=O)c2)c2s1)=O

InChI

InChI=1S/C20H19F2N3O2S/c1-11(2)19(27)25-20-24-16-6-3-12(9-17(16)28-20)4-8-18(26)23-15-7-5-13(21)10-14(15)22/h3,5-7,9-11H,4,8H2,1-2H3,(H,23,26)(H,24,25,27)

InChI Key

UJHPNIRRLZRZTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14945023

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.379

Distribution Coefficient, logD

4.341

Water Solubility, LogSw

-4.28

Polar Surface Area

55.543

Acid Dissociation Constant (pKa)

8.43

Base Dissociation Constant (pKb)

0.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

F222-0884 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F222-0884 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F222-0884?
Check Price and Availability of F222-0884, 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 F222-0884 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F222-0884
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F222-0884
  • 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 F222-0884 available by request