J024-0197 Screening compound: N~10~-(4-fluorophenyl)-11-(2-methoxyphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide

J024-0197 Screening compound: N~10~-(4-fluorophenyl)-11-(2-methoxyphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
J024-0197 Screening compound: N~10~-(4-fluorophenyl)-11-(2-methoxyphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J024-0197
N~10~-(4-fluorophenyl)-11-(2-methoxyphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide

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

J024-0197

Molecular Formula

C29H28FN3O3 (C29 H28 FN3 O3)

Compound Name

N~10~-(4-fluorophenyl)-11-(2-methoxyphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide

IUPAC name

N-(4-fluorophenyl)-10-(2-methoxyphenyl)-1414-dimethyl-12-oxo-29-diazatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)46-tetraene-9-carboxamide

SMILES

CC(C)(C1)CC(Nc(cccc2)c2N(C2c(cccc3)c3OC)C(Nc(cc3)ccc3F)=O)=C2C1=O

InChI

InChI=1S/C29H28FN3O3/c1-29(2)16-22-26(24(34)17-29)27(20-8-4-7-11-25(20)36-3)33(23-10-6-5-9-21(23)32-22)28(35)31-19-14-12-18(30)13-15-19/h4-15,27,32H,16-17H2,1-3H3,(H,31,35)/t27-/m0/s1

InChI Key

DUFREQUFUIORIR-MHZLTWQESA-N

MDL Number (MFCD)

MFCD15078634

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.134

Distribution Coefficient, logD

6.046

Water Solubility, LogSw

-5.62

Polar Surface Area

55.616

Acid Dissociation Constant (pKa)

8.05

Base Dissociation Constant (pKb)

-0.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

24.10

J024-0197 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with J024-0197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J024-0197?
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What is the minimum amount of J024-0197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J024-0197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J024-0197
  • 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 J024-0197 available by request