V010-2129 Screening compound: ethyl 1-(2-fluorophenyl)-5-[3-(2,3,4-trifluorobenzamido)phenyl]-1H-pyrazole-3-carboxylate

V010-2129 Screening compound: ethyl 1-(2-fluorophenyl)-5-[3-(2,3,4-trifluorobenzamido)phenyl]-1H-pyrazole-3-carboxylate
V010-2129 Screening compound: ethyl 1-(2-fluorophenyl)-5-[3-(2,3,4-trifluorobenzamido)phenyl]-1H-pyrazole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-2129
ethyl 1-(2-fluorophenyl)-5-[3-(2,3,4-trifluorobenzamido)phenyl]-1H-pyrazole-3-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

V010-2129

Molecular Formula

C25H17F4N3O3 (C25 H17 F4 N3 O3)

Compound Name

ethyl 1-(2-fluorophenyl)-5-[3-(2,3,4-trifluorobenzamido)phenyl]-1H-pyrazole-3-carboxylate

IUPAC name

ethyl 1-(2-fluorophenyl)-5-[3-(234-trifluorobenzamido)phenyl]-1H-pyrazole-3-carboxylate

SMILES

CCOC(c(cc1-c2cccc(NC(c(c(F)c3F)ccc3F)=O)c2)nn1-c(cccc1)c1F)=O

InChI

InChI=1S/C25H17F4N3O3/c1-2-35-25(34)19-13-21(32(31-19)20-9-4-3-8-17(20)26)14-6-5-7-15(12-14)30-24(33)16-10-11-18(27)23(29)22(16)28/h3-13H,2H2,1H3,(H,30,33)

InChI Key

DUROQUHSBIKJFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19956425

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.005

Distribution Coefficient, logD

6.002

Water Solubility, LogSw

-5.54

Polar Surface Area

56.605

Acid Dissociation Constant (pKa)

9.53

Base Dissociation Constant (pKb)

-2.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

References: we are preparing a list of scientific research reports with V010-2129 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-2129?
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What is the minimum amount of V010-2129 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-2129
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-2129
  • 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 V010-2129 available by request