F292-0698 Screening compound: 3-ethanesulfonamido-4-(4-{[(4-fluorophenyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid

F292-0698 Screening compound: 3-ethanesulfonamido-4-(4-{[(4-fluorophenyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid
F292-0698 Screening compound: 3-ethanesulfonamido-4-(4-{[(4-fluorophenyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound F292-0698
3-ethanesulfonamido-4-(4-{[(4-fluorophenyl)carbamoyl]methyl}piperazin-1-yl)benzoic 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

F292-0698

Molecular Formula

C21H25FN4O5S (C21 H25 FN4 O5 S)

Compound Name

3-ethanesulfonamido-4-(4-{[(4-fluorophenyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid

IUPAC name

3-ethanesulfonamido-4-(4-{[(4-fluorophenyl)carbamoyl]methyl}piperazin-1-yl)benzoic acid

SMILES

CCS(Nc(cc(cc1)C(O)=O)c1N1CCN(CC(Nc(cc2)ccc2F)=O)CC1)(=O)=O

InChI

InChI=1S/C21H25FN4O5S/c1-2-32(30,31)24-18-13-15(21(28)29)3-8-19(18)26-11-9-25(10-12-26)14-20(27)23-17-6-4-16(22)5-7-17/h3-8,13,24H,2,9-12,14H2,1H3,(H,23,27)(H,28,29)

InChI Key

NBVVYLFDNLCMLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27112376

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

464.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.301

Distribution Coefficient, logD

1.540

Water Solubility, LogSw

-3.59

Polar Surface Area

100.338

Acid Dissociation Constant (pKa)

5.65

Base Dissociation Constant (pKb)

4.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with F292-0698 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F292-0698?
Check Price and Availability of F292-0698, 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 F292-0698 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F292-0698
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F292-0698
  • 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 F292-0698 available by request