G784-0234 Screening compound: 2,2,2-trifluoroethyl 1-(4-fluorophenyl)-3-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate

G784-0234 Screening compound: 2,2,2-trifluoroethyl 1-(4-fluorophenyl)-3-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
G784-0234 Screening compound: 2,2,2-trifluoroethyl 1-(4-fluorophenyl)-3-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G784-0234
2,2,2-trifluoroethyl 1-(4-fluorophenyl)-3-methyl-1H-thieno[2,3-c]pyrazole-5-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

G784-0234

Molecular Formula

C15H10F4N2O2S (C15 H10 F4 N2 O2 S)

Compound Name

2,2,2-trifluoroethyl 1-(4-fluorophenyl)-3-methyl-1H-thieno[2,3-c]pyrazole-5-carboxylate

IUPAC name

222-trifluoroethyl 1-(4-fluorophenyl)-3-methyl-1H-thieno[23-c]pyrazole-5-carboxylate

SMILES

Cc(c1c2sc(C(OCC(F)(F)F)=O)c1)nn2-c(cc1)ccc1F

InChI

InChI=1S/C15H10F4N2O2S/c1-8-11-6-12(14(22)23-7-15(17,18)19)24-13(11)21(20-8)10-4-2-9(16)3-5-10/h2-6H,7H2,1H3

InChI Key

QOLLKBZYRQDBGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15035810

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.241

Distribution Coefficient, logD

4.241

Water Solubility, LogSw

-4.35

Polar Surface Area

36.142

Acid Dissociation Constant (pKa)

31.97

Base Dissociation Constant (pKb)

-1.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G784-0234 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G784-0234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G784-0234?
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What is the minimum amount of G784-0234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G784-0234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G784-0234
  • 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 G784-0234 available by request