F487-0003 Screening compound: ethyl 2-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazole-4-carboxylate

F487-0003 Screening compound: ethyl 2-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazole-4-carboxylate
F487-0003 Screening compound: ethyl 2-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazole-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F487-0003
ethyl 2-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazole-4-carboxylate

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

F487-0003

Molecular Formula

C16H12F3N3O2S (C16 H12 F3 N3 O2 S)

Compound Name

ethyl 2-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-1,3-thiazole-4-carboxylate

IUPAC name

ethyl 2-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-1-yl]-13-thiazole-4-carboxylate

SMILES

CCOC(c1csc(-n(c(C(F)(F)F)c2)nc2-c2ccccc2)n1)=O

InChI

InChI=1S/C16H12F3N3O2S/c1-2-24-14(23)12-9-25-15(20-12)22-13(16(17,18)19)8-11(21-22)10-6-4-3-5-7-10/h3-9H,2H2,1H3

InChI Key

KOPPOKJMXPJYQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06241989

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.744

Distribution Coefficient, logD

4.744

Water Solubility, LogSw

-4.54

Polar Surface Area

43.636

Acid Dissociation Constant (pKa)

30.24

Base Dissociation Constant (pKb)

-2.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

F487-0003 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F487-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F487-0003?
Check Price and Availability of F487-0003, 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 F487-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F487-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F487-0003
  • 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 F487-0003 available by request