V028-1647 Screening compound: 5-[4-cyclopentaneamido-2-(morpholine-4-sulfonyl)phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid

V028-1647 Screening compound: 5-[4-cyclopentaneamido-2-(morpholine-4-sulfonyl)phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid
V028-1647 Screening compound: 5-[4-cyclopentaneamido-2-(morpholine-4-sulfonyl)phenoxy]-4-methyl-1-phenyl-1H-pyrazole-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-1647
5-[4-cyclopentaneamido-2-(morpholine-4-sulfonyl)phenoxy]-4-methyl-1-phenyl-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

V028-1647

Molecular Formula

C27H30N4O7S (C27 H30 N4 O7 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(c(C(O)=O)nn1-c2ccccc2)c1Oc(ccc(NC(C1CCCC1)=O)c1)c1S(N1CCOCC1)(=O)=O

InChI

InChI=1S/C27H30N4O7S/c1-18-24(27(33)34)29-31(21-9-3-2-4-10-21)26(18)38-22-12-11-20(28-25(32)19-7-5-6-8-19)17-23(22)39(35,36)30-13-15-37-16-14-30/h2-4,9-12,17,19H,5-8,13-16H2,1H3,(H,28,32)(H,33,34)

InChI Key

JNOSITHBGXSHSP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19789078

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

554.62

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

3.155

Distribution Coefficient, logD

-1.361

Water Solubility, LogSw

-3.43

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

V028-1647 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V028-1647 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-1647?
Check Price and Availability of V028-1647, 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 V028-1647 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-1647
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-1647
  • 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 V028-1647 available by request