3788-0891 Screening compound: 2-[N-(4-fluorophenyl)benzenesulfonamido]-N-[4-(piperidine-1-sulfonyl)phenyl]acetamide

3788-0891 Screening compound: 2-[N-(4-fluorophenyl)benzenesulfonamido]-N-[4-(piperidine-1-sulfonyl)phenyl]acetamide
3788-0891 Screening compound: 2-[N-(4-fluorophenyl)benzenesulfonamido]-N-[4-(piperidine-1-sulfonyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3788-0891
2-[N-(4-fluorophenyl)benzenesulfonamido]-N-[4-(piperidine-1-sulfonyl)phenyl]acetamide

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

3788-0891

Molecular Formula

C25H26FN3O5S2 (C25 H26 FN3 O5 S2)

Compound Name

2-[N-(4-fluorophenyl)benzenesulfonamido]-N-[4-(piperidine-1-sulfonyl)phenyl]acetamide

IUPAC name

2-[N-(4-fluorophenyl)benzenesulfonamido]-N-[4-(piperidine-1-sulfonyl)phenyl]acetamide

SMILES

O=C(CN(c(cc1)ccc1F)S(c1ccccc1)(=O)=O)Nc(cc1)ccc1S(N1CCCCC1)(=O)=O

InChI

InChI=1S/C25H26FN3O5S2/c26-20-9-13-22(14-10-20)29(36(33,34)23-7-3-1-4-8-23)19-25(30)27-21-11-15-24(16-12-21)35(31,32)28-17-5-2-6-18-28/h1,3-4,7-16H,2,5-6,17-19H2,(H,27,30)

InChI Key

IXZBPMMPVHRYFS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02806900

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

531.63

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.020

Distribution Coefficient, logD

4.019

Water Solubility, LogSw

-4.01

Polar Surface Area

86.653

Acid Dissociation Constant (pKa)

10.29

Base Dissociation Constant (pKb)

-2.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

3788-0891 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 3788-0891 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3788-0891?
Check Price and Availability of 3788-0891, 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 3788-0891 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3788-0891
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3788-0891
  • 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 3788-0891 available by request