S734-0984 Screening compound: 5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazecan-1-yl)ethyl]furan-2-carboxamide

S734-0984 Screening compound: 5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazecan-1-yl)ethyl]furan-2-carboxamide
S734-0984 Screening compound: 5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazecan-1-yl)ethyl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S734-0984
5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazecan-1-yl)ethyl]furan-2-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

S734-0984

Molecular Formula

C27H33N5O4 (C27 H33 N5 O4)

Compound Name

5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazecan-1-yl)ethyl]furan-2-carboxamide

IUPAC name

5-[(35-dimethyl-1H-pyrazol-1-yl)methyl]-N-[2-oxo-2-(4-oxo-2-phenyl-15-diazecan-1-yl)ethyl]furan-2-carboxamide

SMILES

Cc1cc(C)nn1Cc1ccc(C(NCC(N(CCCCCNC(C2)=O)C2c2ccccc2)=O)=O)o1

InChI

InChI=1S/C27H33N5O4/c1-19-15-20(2)32(30-19)18-22-11-12-24(36-22)27(35)29-17-26(34)31-14-8-4-7-13-28-25(33)16-23(31)21-9-5-3-6-10-21/h3,5-6,9-12,15,23H,4,7-8,13-14,16-18H2,1-2H3,(H,28,33)(H,29,35)/t23-/m0/s1

InChI Key

ABFCGCCIERRFCS-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD30463762

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.473

Distribution Coefficient, logD

1.473

Water Solubility, LogSw

-2.10

Polar Surface Area

87.398

Acid Dissociation Constant (pKa)

12.42

Base Dissociation Constant (pKb)

1.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.74

S734-0984 in Drug Discovery

Included in Screening Libraries

Macrocycles Library (2450 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S734-0984 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S734-0984?
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What is the minimum amount of S734-0984 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S734-0984
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S734-0984
  • 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 S734-0984 available by request