J024-0477 Screening compound: 10-ethyl-11-(2-methoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

J024-0477 Screening compound: 10-ethyl-11-(2-methoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
J024-0477 Screening compound: 10-ethyl-11-(2-methoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J024-0477
10-ethyl-11-(2-methoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-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

J024-0477

Molecular Formula

C24H28N2O2 (C24 H28 N2 O2)

Compound Name

10-ethyl-11-(2-methoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

IUPAC name

9-ethyl-10-(2-methoxyphenyl)-1414-dimethyl-29-diazatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)46-tetraen-12-one

SMILES

CCN(C1c(cccc2)c2OC)c(cccc2)c2NC(CC(C)(C)C2)=C1C2=O

InChI

InChI=1S/C24H28N2O2/c1-5-26-19-12-8-7-11-17(19)25-18-14-24(2,3)15-20(27)22(18)23(26)16-10-6-9-13-21(16)28-4/h6-13,23,25H,5,14-15H2,1-4H3/t23-/m0/s1

InChI Key

HZYHHNHWMRSWLX-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD18912714

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.5

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.155

Distribution Coefficient, logD

5.121

Water Solubility, LogSw

-5.03

Polar Surface Area

34.207

Acid Dissociation Constant (pKa)

8.49

Base Dissociation Constant (pKb)

9.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

J024-0477 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with J024-0477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J024-0477?
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What is the minimum amount of J024-0477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J024-0477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J024-0477
  • 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 J024-0477 available by request