J030-1365 Screening compound: 7-methyl-3-(4-methylphenoxy)-2-(morpholinosulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one

J030-1365 Screening compound: 7-methyl-3-(4-methylphenoxy)-2-(morpholinosulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
J030-1365 Screening compound: 7-methyl-3-(4-methylphenoxy)-2-(morpholinosulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J030-1365
7-methyl-3-(4-methylphenoxy)-2-(morpholinosulfonyl)dibenzo[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

J030-1365

Molecular Formula

C25H24N2O6S (C25 H24 N2 O6 S)

Compound Name

7-methyl-3-(4-methylphenoxy)-2-(morpholinosulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one

IUPAC name

5-methyl-14-(4-methylphenoxy)-13-(morpholine-4-sulfonyl)-2-oxa-9-azatricyclo[9.4.0.0^{38}]pentadeca-1(15)3571113-hexaen-10-one

SMILES

Cc(cc1)ccc1Oc(cc(c1c2)Oc(cc(C)cc3)c3NC1=O)c2S(N1CCOCC1)(=O)=O

InChI

InChI=1S/C25H24N2O6S/c1-16-3-6-18(7-4-16)32-23-15-21-19(14-24(23)34(29,30)27-9-11-31-12-10-27)25(28)26-20-8-5-17(2)13-22(20)33-21/h3-8,13-15H,9-12H2,1-2H3,(H,26,28)

InChI Key

LXTZBHZPOOPFMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27220597

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.719

Distribution Coefficient, logD

4.689

Water Solubility, LogSw

-4.37

Polar Surface Area

78.794

Acid Dissociation Constant (pKa)

8.55

Base Dissociation Constant (pKb)

-2.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

J030-1365 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with J030-1365 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J030-1365?
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What is the minimum amount of J030-1365 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J030-1365
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J030-1365
  • 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 J030-1365 available by request