F091-0657 Screening compound: 1-{4-amino-2-[(3-chloro-4-fluorophenyl)amino]-1,3-thiazol-5-yl}ethan-1-one

F091-0657 Screening compound: 1-{4-amino-2-[(3-chloro-4-fluorophenyl)amino]-1,3-thiazol-5-yl}ethan-1-one
F091-0657 Screening compound: 1-{4-amino-2-[(3-chloro-4-fluorophenyl)amino]-1,3-thiazol-5-yl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F091-0657
1-{4-amino-2-[(3-chloro-4-fluorophenyl)amino]-1,3-thiazol-5-yl}ethan-1-one

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

F091-0657

Molecular Formula

C11H9ClFN3OS (C11 H9 ClFN3 OS)

Compound Name

1-{4-amino-2-[(3-chloro-4-fluorophenyl)amino]-1,3-thiazol-5-yl}ethan-1-one

IUPAC name

1-{4-amino-2-[(3-chloro-4-fluorophenyl)amino]-13-thiazol-5-yl}ethan-1-one

SMILES

CC(c1c(N)nc(Nc(cc2)cc(Cl)c2F)s1)=O

InChI

InChI=1S/C11H9ClFN3OS/c1-5(17)9-10(14)16-11(18-9)15-6-2-3-8(13)7(12)4-6/h2-4H,14H2,1H3,(H,15,16)

InChI Key

MWCWNXUVVJQDFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03863378

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

285.73

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.233

Distribution Coefficient, logD

3.233

Water Solubility, LogSw

-3.60

Polar Surface Area

53.721

Acid Dissociation Constant (pKa)

14.77

Base Dissociation Constant (pKb)

3.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

F091-0657 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F091-0657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F091-0657?
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What is the minimum amount of F091-0657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F091-0657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F091-0657
  • 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 F091-0657 available by request