E646-1706 Screening compound: N-cycloheptyl-1-(2,5-dimethylphenyl)-2-methyl-6-oxo-4-(propane-1-sulfonyl)piperazine-2-carboxamide

E646-1706 Screening compound: N-cycloheptyl-1-(2,5-dimethylphenyl)-2-methyl-6-oxo-4-(propane-1-sulfonyl)piperazine-2-carboxamide
E646-1706 Screening compound: N-cycloheptyl-1-(2,5-dimethylphenyl)-2-methyl-6-oxo-4-(propane-1-sulfonyl)piperazine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E646-1706
N-cycloheptyl-1-(2,5-dimethylphenyl)-2-methyl-6-oxo-4-(propane-1-sulfonyl)piperazine-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

E646-1706

Molecular Formula

C24H37N3O4S (C24 H37 N3 O4 S)

Compound Name

N-cycloheptyl-1-(2,5-dimethylphenyl)-2-methyl-6-oxo-4-(propane-1-sulfonyl)piperazine-2-carboxamide

IUPAC name

N-cycloheptyl-1-(25-dimethylphenyl)-2-methyl-6-oxo-4-(propane-1-sulfonyl)piperazine-2-carboxamide

SMILES

CCCS(N(CC(C)(C(NC1CCCCCC1)=O)N1c2c(C)ccc(C)c2)CC1=O)(=O)=O

InChI

InChI=1S/C24H37N3O4S/c1-5-14-32(30,31)26-16-22(28)27(21-15-18(2)12-13-19(21)3)24(4,17-26)23(29)25-20-10-8-6-7-9-11-20/h12-13,15,20H,5-11,14,16-17H2,1-4H3,(H,25,29)/t24-/m0/s1

InChI Key

PZVSXUZTYSMEBA-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD14908097

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.64

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.035

Distribution Coefficient, logD

4.035

Water Solubility, LogSw

-4.01

Polar Surface Area

71.591

Acid Dissociation Constant (pKa)

13.49

Base Dissociation Constant (pKb)

0.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.70

E646-1706 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CORONAVIRUS Library (20774 compounds)

Cyclic Ugi PPI Library (9586 compounds)

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Anti-HIV1 Library (19540 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with E646-1706 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E646-1706?
Check Price and Availability of E646-1706, 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 E646-1706 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E646-1706
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E646-1706
  • 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 E646-1706 available by request