V031-3045 Screening compound: 2-[4-(4-fluorobenzenesulfonamido)piperidin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]benzamide

V031-3045 Screening compound: 2-[4-(4-fluorobenzenesulfonamido)piperidin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]benzamide
V031-3045 Screening compound: 2-[4-(4-fluorobenzenesulfonamido)piperidin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-3045
2-[4-(4-fluorobenzenesulfonamido)piperidin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]benzamide

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

V031-3045

Molecular Formula

C27H30FN3O4S (C27 H30 FN3 O4 S)

Compound Name

2-[4-(4-fluorobenzenesulfonamido)piperidin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]benzamide

IUPAC name

2-[4-(4-fluorobenzenesulfonamido)piperidin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]benzamide

SMILES

COc1ccc(CCNC(c(cccc2)c2N(CC2)CCC2NS(c(cc2)ccc2F)(=O)=O)=O)cc1

InChI

InChI=1S/C27H30FN3O4S/c1-35-23-10-6-20(7-11-23)14-17-29-27(32)25-4-2-3-5-26(25)31-18-15-22(16-19-31)30-36(33,34)24-12-8-21(28)9-13-24/h2-13,22,30H,14-19H2,1H3,(H,29,32)

InChI Key

VQFQQKJKMYYFMG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19894975

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

511.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.489

Distribution Coefficient, logD

4.489

Water Solubility, LogSw

-4.31

Polar Surface Area

76.693

Acid Dissociation Constant (pKa)

11.07

Base Dissociation Constant (pKb)

8.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

V031-3045 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with V031-3045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-3045?
Check Price and Availability of V031-3045, 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 V031-3045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-3045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-3045
  • 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 V031-3045 available by request