6028-2315 Screening compound: 2-benzyl-3-(3-bromophenyl)-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione

6028-2315 Screening compound: 2-benzyl-3-(3-bromophenyl)-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
6028-2315 Screening compound: 2-benzyl-3-(3-bromophenyl)-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 6028-2315
2-benzyl-3-(3-bromophenyl)-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione

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

6028-2315

Molecular Formula

C20H17BrN2O2S (C20 H17 BrN2 O2 S)

Compound Name

2-benzyl-3-(3-bromophenyl)-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione

IUPAC name

2-benzyl-3-(3-bromophenyl)-34-dihydro-2H-1lambda624-benzothiadiazine-11-dione

SMILES

O=S1(N(Cc2ccccc2)C(c2cccc(Br)c2)Nc2c1cccc2)=O

InChI

InChI=1S/C20H17BrN2O2S/c21-17-10-6-9-16(13-17)20-22-18-11-4-5-12-19(18)26(24,25)23(20)14-15-7-2-1-3-8-15/h1-13,20,22H,14H2/t20-/m0/s1

InChI Key

KXXBMLZTDPOSSF-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD03828368

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.931

Distribution Coefficient, logD

4.931

Water Solubility, LogSw

-4.92

Polar Surface Area

43.035

Acid Dissociation Constant (pKa)

16.39

Base Dissociation Constant (pKb)

-5.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.00

6028-2315 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiparasite Library (23996 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6028-2315 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6028-2315?
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What is the minimum amount of 6028-2315 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6028-2315
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6028-2315
  • 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 6028-2315 available by request