F724-0235 Screening compound: 2-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}-6-pentanamidoquinoline-4-carboxylic acid

F724-0235 Screening compound: 2-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}-6-pentanamidoquinoline-4-carboxylic acid
F724-0235 Screening compound: 2-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}-6-pentanamidoquinoline-4-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound F724-0235
2-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}-6-pentanamidoquinoline-4-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

F724-0235

Molecular Formula

C26H29ClN4O3 (C26 H29 ClN4 O3)

Compound Name

2-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}-6-pentanamidoquinoline-4-carboxylic acid

IUPAC name

2-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}-6-pentanamidoquinoline-4-carboxylic acid

SMILES

CCCCC(Nc(cc1c(C(O)=O)c2)ccc1nc2N1CCN(Cc2cccc(Cl)c2)CC1)=O

InChI

InChI=1S/C26H29ClN4O3/c1-2-3-7-25(32)28-20-8-9-23-21(15-20)22(26(33)34)16-24(29-23)31-12-10-30(11-13-31)17-18-5-4-6-19(27)14-18/h4-6,8-9,14-16H,2-3,7,10-13,17H2,1H3,(H,28,32)(H,33,34)

InChI Key

VKVBIFAFGBAILU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14964663

Chemical and Physical Properties

Saltdata

3HCl

Molecular Weight

480.99

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.609

Distribution Coefficient, logD

2.665

Water Solubility, LogSw

-5.46

Polar Surface Area

66.583

Acid Dissociation Constant (pKa)

4.46

Base Dissociation Constant (pKb)

6.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

F724-0235 in Drug Discovery

Included in Screening Libraries

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

Macl-GPIb alpha Interaction Library (22969 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with F724-0235 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F724-0235?
Check Price and Availability of F724-0235, 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 F724-0235 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F724-0235
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F724-0235
  • 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 F724-0235 available by request