F992-0246 Screening compound: 11-{4-[(2,5-dimethoxyphenyl)sulfonyl]piperazino}dibenzo[b,f][1,4]oxazepine

F992-0246 Screening compound: 11-{4-[(2,5-dimethoxyphenyl)sulfonyl]piperazino}dibenzo[b,f][1,4]oxazepine
F992-0246 Screening compound: 11-{4-[(2,5-dimethoxyphenyl)sulfonyl]piperazino}dibenzo[b,f][1,4]oxazepine alternative view

Chemical Structure Depiction of ChemDiv screening compound F992-0246
11-{4-[(2,5-dimethoxyphenyl)sulfonyl]piperazino}dibenzo[b,f][1,4]oxazepine

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

F992-0246

Molecular Formula

C25H25N3O5S (C25 H25 N3 O5 S)

Compound Name

11-{4-[(2,5-dimethoxyphenyl)sulfonyl]piperazino}dibenzo[b,f][1,4]oxazepine

IUPAC name

10-[4-(25-dimethoxybenzenesulfonyl)piperazin-1-yl]-2-oxa-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)4691214-heptaene

SMILES

COc(cc1)cc(S(N(CC2)CCN2C2=Nc(cccc3)c3Oc3c2cccc3)(=O)=O)c1OC

InChI

InChI=1S/C25H25N3O5S/c1-31-18-11-12-23(32-2)24(17-18)34(29,30)28-15-13-27(14-16-28)25-19-7-3-5-9-21(19)33-22-10-6-4-8-20(22)26-25/h3-12,17H,13-16H2,1-2H3

InChI Key

GBMDAKWVSKZHAJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14973933

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.751

Distribution Coefficient, logD

2.909

Water Solubility, LogSw

-4.14

Polar Surface Area

64.955

Acid Dissociation Constant (pKa)

28.25

Base Dissociation Constant (pKb)

8.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

F992-0246 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

KRAS-Targeted Library (16000 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
  • Female
  • Congenital
  • Skin
  • Nervous system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • Kinases
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F992-0246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F992-0246?
Check Price and Availability of F992-0246, 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 F992-0246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F992-0246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F992-0246
  • 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 F992-0246 available by request