G801-1533 Screening compound: 6-bromo-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide

G801-1533 Screening compound: 6-bromo-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide
G801-1533 Screening compound: 6-bromo-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G801-1533
6-bromo-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide

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

G801-1533

Molecular Formula

C19H21BrFN5O3S (C19 H21 BrFN5 O3 S)

Compound Name

6-bromo-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide

IUPAC name

6-bromo-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-2-oxo-23-dihydro-1H-13-benzodiazole-5-sulfonamide

SMILES

O=C(Nc1c2)Nc1cc(Br)c2S(NCCN(CC1)CCN1c(cccc1)c1F)(=O)=O

InChI

InChI=1S/C19H21BrFN5O3S/c20-13-11-15-16(24-19(27)23-15)12-18(13)30(28,29)22-5-6-25-7-9-26(10-8-25)17-4-2-1-3-14(17)21/h1-4,11-12,22H,5-10H2,(H2,23,24,27)

InChI Key

ZMIFNLFDHAJJQB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27161080

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.728

Distribution Coefficient, logD

2.627

Water Solubility, LogSw

-3.43

Polar Surface Area

84.507

Acid Dissociation Constant (pKa)

8.01

Base Dissociation Constant (pKb)

5.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

G801-1533 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G801-1533 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G801-1533?
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What is the minimum amount of G801-1533 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G801-1533
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G801-1533
  • 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 G801-1533 available by request