8008-4936 Screening compound: 4-(2-{[1-(4-fluorophenyl)-2,5-dioxotetrahydro-1H-pyrrol-3-yl]amino}ethyl)-1-benzenesulfonamide

8008-4936 Screening compound: 4-(2-{[1-(4-fluorophenyl)-2,5-dioxotetrahydro-1H-pyrrol-3-yl]amino}ethyl)-1-benzenesulfonamide
8008-4936 Screening compound: 4-(2-{[1-(4-fluorophenyl)-2,5-dioxotetrahydro-1H-pyrrol-3-yl]amino}ethyl)-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-4936
4-(2-{[1-(4-fluorophenyl)-2,5-dioxotetrahydro-1H-pyrrol-3-yl]amino}ethyl)-1-benzenesulfonamide

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

8008-4936

Molecular Formula

C18H18FN3O4S (C18 H18 FN3 O4 S)

Compound Name

4-(2-{[1-(4-fluorophenyl)-2,5-dioxotetrahydro-1H-pyrrol-3-yl]amino}ethyl)-1-benzenesulfonamide

IUPAC name

4-(2-{[1-(4-fluorophenyl)-25-dioxopyrrolidin-3-yl]amino}ethyl)benzene-1-sulfonamide

SMILES

NS(c1ccc(CCNC(CC(N2c(cc3)ccc3F)=O)C2=O)cc1)(=O)=O

InChI

InChI=1S/C18H18FN3O4S/c19-13-3-5-14(6-4-13)22-17(23)11-16(18(22)24)21-10-9-12-1-7-15(8-2-12)27(20,25)26/h1-8,16,21H,9-11H2,(H2,20,25,26)/t16-/m0/s1

InChI Key

DVCSXDVBVWNFOR-INIZCTEOSA-N

MDL Number (MFCD)

MFCD01130349

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.403

Distribution Coefficient, logD

-0.404

Water Solubility, LogSw

-2.02

Polar Surface Area

91.354

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

4.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.22

8008-4936 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with 8008-4936 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-4936?
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What is the minimum amount of 8008-4936 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-4936
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-4936
  • 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 8008-4936 available by request