F992-0023 Screening compound: 1-(4-dibenzo[b,f][1,4]oxazepin-11-ylpiperazino)-3-(4-methoxyphenyl)-1-propanone

F992-0023 Screening compound: 1-(4-dibenzo[b,f][1,4]oxazepin-11-ylpiperazino)-3-(4-methoxyphenyl)-1-propanone
F992-0023 Screening compound: 1-(4-dibenzo[b,f][1,4]oxazepin-11-ylpiperazino)-3-(4-methoxyphenyl)-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound F992-0023
1-(4-dibenzo[b,f][1,4]oxazepin-11-ylpiperazino)-3-(4-methoxyphenyl)-1-propanone

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

F992-0023

Molecular Formula

C27H27N3O3 (C27 H27 N3 O3)

Compound Name

1-(4-dibenzo[b,f][1,4]oxazepin-11-ylpiperazino)-3-(4-methoxyphenyl)-1-propanone

IUPAC name

3-(4-methoxyphenyl)-1-(4-{2-oxa-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)4691214-heptaen-10-yl}piperazin-1-yl)propan-1-one

SMILES

COc1ccc(CCC(N(CC2)CCN2C2=Nc(cccc3)c3Oc3c2cccc3)=O)cc1

InChI

InChI=1S/C27H27N3O3/c1-32-21-13-10-20(11-14-21)12-15-26(31)29-16-18-30(19-17-29)27-22-6-2-4-8-24(22)33-25-9-5-3-7-23(25)28-27/h2-11,13-14H,12,15-19H2,1H3

InChI Key

DPKSNDIKPRNUTK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14973882

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.229

Distribution Coefficient, logD

3.861

Water Solubility, LogSw

-4.45

Polar Surface Area

41.734

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

7.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

F992-0023 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

Akt-Targeted Library (14764 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F992-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F992-0023?
Check Price and Availability of F992-0023, 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 F992-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F992-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F992-0023
  • 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 F992-0023 available by request