V025-8885 Screening compound: 5-{4-acetamido-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid

V025-8885 Screening compound: 5-{4-acetamido-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
V025-8885 Screening compound: 5-{4-acetamido-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-8885
5-{4-acetamido-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid

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

V025-8885

Molecular Formula

C22H23FN4O6S (C22 H23 FN4 O6 S)

Compound Name

5-{4-acetamido-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid

IUPAC name

5-{4-acetamido-2-[(propan-2-yl)sulfamoyl]phenoxy}-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid

SMILES

CC(C)NS(c(cc(cc1)NC(C)=O)c1Oc1c(C)c(C(O)=O)nn1-c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C22H23FN4O6S/c1-12(2)26-34(31,32)19-11-16(24-14(4)28)7-10-18(19)33-21-13(3)20(22(29)30)25-27(21)17-8-5-15(23)6-9-17/h5-12,26H,1-4H3,(H,24,28)(H,29,30)

InChI Key

RZHQYQHBLYMKCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19786247

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

490.51

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.537

Distribution Coefficient, logD

-1.979

Water Solubility, LogSw

-3.06

Polar Surface Area

114.088

Acid Dissociation Constant (pKa)

2.88

Base Dissociation Constant (pKb)

-0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

V025-8885 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V025-8885 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-8885?
Check Price and Availability of V025-8885, 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 V025-8885 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-8885
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-8885
  • 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 V025-8885 available by request