C200-9269 Screening compound: 4-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethylphenyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione

C200-9269 Screening compound: 4-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethylphenyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
C200-9269 Screening compound: 4-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethylphenyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-9269
4-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethylphenyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione

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

C200-9269

Molecular Formula

C23H20N2O5S (C23 H20 N2 O5 S)

Compound Name

4-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethylphenyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione

IUPAC name

4-[(2H-13-benzodioxol-5-yl)methyl]-2-(4-ethylphenyl)-34-dihydro-2H-1lambda624-benzothiadiazine-113-trione

SMILES

CCc(cc1)ccc1N(C(N(Cc(cc1)cc2c1OCO2)c1c2cccc1)=O)S2(=O)=O

InChI

InChI=1S/C23H20N2O5S/c1-2-16-7-10-18(11-8-16)25-23(26)24(19-5-3-4-6-22(19)31(25,27)28)14-17-9-12-20-21(13-17)30-15-29-20/h3-13H,2,14-15H2,1H3

InChI Key

RUSOQNCZPQOVAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.056

Distribution Coefficient, logD

5.056

Water Solubility, LogSw

-4.61

Polar Surface Area

63.858

Acid Dissociation Constant (pKa)

26.44

Base Dissociation Constant (pKb)

-9.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

C200-9269 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C200-9269 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-9269?
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What is the minimum amount of C200-9269 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-9269
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-9269
  • 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 C200-9269 available by request