8019-8264 Screening compound: 8-chlorodibenzo[b,f][1,4]oxazepin-11(10H)-one

8019-8264 Screening compound: 8-chlorodibenzo[b,f][1,4]oxazepin-11(10H)-one
8019-8264 Screening compound: 8-chlorodibenzo[b,f][1,4]oxazepin-11(10H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-8264
8-chlorodibenzo[b,f][1,4]oxazepin-11(10H)-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

8019-8264

Molecular Formula

C13H8ClNO2 (C13 H8 ClNO2)

Compound Name

8-chlorodibenzo[b,f][1,4]oxazepin-11(10H)-one

IUPAC name

6-chloro-2-oxa-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)461214-hexaen-10-one

SMILES

O=C1Nc(cc(cc2)Cl)c2Oc2c1cccc2

InChI

InChI=1S/C13H8ClNO2/c14-8-5-6-12-10(7-8)15-13(16)9-3-1-2-4-11(9)17-12/h1-7H,(H,15,16)

InChI Key

CQTGCCLTIDNYHT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00233637

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

245.66

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.188

Distribution Coefficient, logD

2.743

Water Solubility, LogSw

-3.92

Polar Surface Area

32.340

Acid Dissociation Constant (pKa)

7.15

Base Dissociation Constant (pKb)

-2.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8019-8264 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8019-8264 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-8264?
Check Price and Availability of 8019-8264, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8019-8264 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-8264
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-8264
  • 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 8019-8264 available by request