C566-0145 Screening compound: 3-(3,4-dichlorobenzenesulfonyl)-8-methoxy-2H-chromen-2-one

C566-0145 Screening compound: 3-(3,4-dichlorobenzenesulfonyl)-8-methoxy-2H-chromen-2-one
C566-0145 Screening compound: 3-(3,4-dichlorobenzenesulfonyl)-8-methoxy-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C566-0145
3-(3,4-dichlorobenzenesulfonyl)-8-methoxy-2H-chromen-2-one

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

C566-0145

Molecular Formula

C16H10Cl2O5S (C16 H10 Cl2 O5 S)

Compound Name

3-(3,4-dichlorobenzenesulfonyl)-8-methoxy-2H-chromen-2-one

IUPAC name

3-(34-dichlorobenzenesulfonyl)-8-methoxy-2H-chromen-2-one

SMILES

COc1cccc(C=C2S(c(cc3)cc(Cl)c3Cl)(=O)=O)c1OC2=O

InChI

InChI=1S/C16H10Cl2O5S/c1-22-13-4-2-3-9-7-14(16(19)23-15(9)13)24(20,21)10-5-6-11(17)12(18)8-10/h2-8H,1H3

InChI Key

GUCWIEBVKYMMIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11995966

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.22

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.831

Distribution Coefficient, logD

3.831

Water Solubility, LogSw

-4.13

Polar Surface Area

57.976

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

C566-0145 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C566-0145 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C566-0145?
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What is the minimum amount of C566-0145 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C566-0145
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C566-0145
  • 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 C566-0145 available by request