8020-0333 Screening compound: 2,8-dichloro-10-methyl-10H-isoindolo[1,2-b][1,3]benzoxazin-12(4bH)-one

8020-0333 Screening compound: 2,8-dichloro-10-methyl-10H-isoindolo[1,2-b][1,3]benzoxazin-12(4bH)-one
8020-0333 Screening compound: 2,8-dichloro-10-methyl-10H-isoindolo[1,2-b][1,3]benzoxazin-12(4bH)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-0333
2,8-dichloro-10-methyl-10H-isoindolo[1,2-b][1,3]benzoxazin-12(4bH)-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

8020-0333

Molecular Formula

C16H11Cl2NO2 (C16 H11 Cl2 NO2)

Compound Name

2,8-dichloro-10-methyl-10H-isoindolo[1,2-b][1,3]benzoxazin-12(4bH)-one

IUPAC name

514-dichloro-2-methyl-9-oxa-1-azatetracyclo[8.7.0.0^{38}.0^{1116}]heptadeca-3(8)4611(16)1214-hexaen-17-one

SMILES

CC(c(cc(cc1)Cl)c1OC1c(cc2)c3cc2Cl)N1C3=O

InChI

InChI=1S/C16H11Cl2NO2/c1-8-12-6-10(18)3-5-14(12)21-16-11-4-2-9(17)7-13(11)15(20)19(8)16/h2-8,16H,1H3

InChI Key

ZCXLIHVLCDZOOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12034715

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.17

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.470

Distribution Coefficient, logD

4.470

Water Solubility, LogSw

-4.63

Polar Surface Area

23.024

Acid Dissociation Constant (pKa)

21.84

Base Dissociation Constant (pKb)

-7.28

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

18.80

8020-0333 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8020-0333 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-0333?
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What is the minimum amount of 8020-0333 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-0333
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-0333
  • 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 8020-0333 available by request