V026-2856 Screening compound: 5-[4-cyclopentaneamido-2-(morpholine-4-sulfonyl)phenoxy]-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid

V026-2856 Screening compound: 5-[4-cyclopentaneamido-2-(morpholine-4-sulfonyl)phenoxy]-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid
V026-2856 Screening compound: 5-[4-cyclopentaneamido-2-(morpholine-4-sulfonyl)phenoxy]-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-2856
5-[4-cyclopentaneamido-2-(morpholine-4-sulfonyl)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

V026-2856

Molecular Formula

C27H29FN4O7S (C27 H29 FN4 O7 S)

Compound Name

5-[4-cyclopentaneamido-2-(morpholine-4-sulfonyl)phenoxy]-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid

IUPAC name

5-[4-cyclopentaneamido-2-(morpholine-4-sulfonyl)phenoxy]-1-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxylic acid

SMILES

Cc(c(C(O)=O)nn1-c(cc2)ccc2F)c1Oc(ccc(NC(C1CCCC1)=O)c1)c1S(N1CCOCC1)(=O)=O

InChI

InChI=1S/C27H29FN4O7S/c1-17-24(27(34)35)30-32(21-9-6-19(28)7-10-21)26(17)39-22-11-8-20(29-25(33)18-4-2-3-5-18)16-23(22)40(36,37)31-12-14-38-15-13-31/h6-11,16,18H,2-5,12-15H2,1H3,(H,29,33)(H,34,35)

InChI Key

QTVYVPZFDPNOSZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19792237

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

572.61

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.306

Distribution Coefficient, logD

-1.210

Water Solubility, LogSw

-3.58

Polar Surface Area

112.877

Acid Dissociation Constant (pKa)

2.88

Base Dissociation Constant (pKb)

-0.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

V026-2856 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V026-2856 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-2856?
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What is the minimum amount of V026-2856 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-2856
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-2856
  • 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 V026-2856 available by request