C567-0897 Screening compound: 7-(4-chlorobenzoyl)-5-[(3-methoxyphenyl)methyl]-2H,5H,8H-[1,3]dioxolo[4,5-g]quinolin-8-one

C567-0897 Screening compound: 7-(4-chlorobenzoyl)-5-[(3-methoxyphenyl)methyl]-2H,5H,8H-[1,3]dioxolo[4,5-g]quinolin-8-one
C567-0897 Screening compound: 7-(4-chlorobenzoyl)-5-[(3-methoxyphenyl)methyl]-2H,5H,8H-[1,3]dioxolo[4,5-g]quinolin-8-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C567-0897
7-(4-chlorobenzoyl)-5-[(3-methoxyphenyl)methyl]-2H,5H,8H-[1,3]dioxolo[4,5-g]quinolin-8-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

C567-0897

Molecular Formula

C25H18ClNO5 (C25 H18 ClNO5)

Compound Name

7-(4-chlorobenzoyl)-5-[(3-methoxyphenyl)methyl]-2H,5H,8H-[1,3]dioxolo[4,5-g]quinolin-8-one

IUPAC name

7-(4-chlorobenzoyl)-5-[(3-methoxyphenyl)methyl]-2H5H8H-[13]dioxolo[45-g]quinolin-8-one

SMILES

COc1cccc(CN(C=C2C(c(cc3)ccc3Cl)=O)c(cc3OCOc3c3)c3C2=O)c1

InChI

InChI=1S/C25H18ClNO5/c1-30-18-4-2-3-15(9-18)12-27-13-20(24(28)16-5-7-17(26)8-6-16)25(29)19-10-22-23(11-21(19)27)32-14-31-22/h2-11,13H,12,14H2,1H3

InChI Key

MABGFRBKZMRRPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05899685

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.87

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.965

Distribution Coefficient, logD

4.965

Water Solubility, LogSw

-5.10

Polar Surface Area

53.689

Acid Dissociation Constant (pKa)

29.88

Base Dissociation Constant (pKb)

-3.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

C567-0897 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C567-0897 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C567-0897?
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What is the minimum amount of C567-0897 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C567-0897
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C567-0897
  • 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 C567-0897 available by request