K784-5979 Screening compound: 4-[2-(3,4-dimethoxyphenyl)ethyl]-3-[3-methoxy-4-(propan-2-yloxy)phenyl]-1-(4-methylcyclohexyl)piperazine-2,5-dione

K784-5979 Screening compound: 4-[2-(3,4-dimethoxyphenyl)ethyl]-3-[3-methoxy-4-(propan-2-yloxy)phenyl]-1-(4-methylcyclohexyl)piperazine-2,5-dione
K784-5979 Screening compound: 4-[2-(3,4-dimethoxyphenyl)ethyl]-3-[3-methoxy-4-(propan-2-yloxy)phenyl]-1-(4-methylcyclohexyl)piperazine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-5979
4-[2-(3,4-dimethoxyphenyl)ethyl]-3-[3-methoxy-4-(propan-2-yloxy)phenyl]-1-(4-methylcyclohexyl)piperazine-2,5-dione

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

K784-5979

Molecular Formula

C31H42N2O6 (C31 H42 N2 O6)

Compound Name

4-[2-(3,4-dimethoxyphenyl)ethyl]-3-[3-methoxy-4-(propan-2-yloxy)phenyl]-1-(4-methylcyclohexyl)piperazine-2,5-dione

IUPAC name

4-[2-(34-dimethoxyphenyl)ethyl]-3-[3-methoxy-4-(propan-2-yloxy)phenyl]-1-(4-methylcyclohexyl)piperazine-25-dione

SMILES

CC(C)Oc(ccc(C(C(N(C1)C2CCC(C)CC2)=O)N(CCc(cc2)cc(OC)c2OC)C1=O)c1)c1OC

InChI

InChI=1S/C31H42N2O6/c1-20(2)39-26-14-10-23(18-28(26)38-6)30-31(35)33(24-11-7-21(3)8-12-24)19-29(34)32(30)16-15-22-9-13-25(36-4)27(17-22)37-5/h9-10,13-14,17-18,20-21,24,30H,7-8,11-12,15-16,19H2,1-6H3/t21?,24?,30-/m0/s1

InChI Key

ZEFAZFZCLIAXPL-YHFVJUSRSA-N

MDL Number (MFCD)

MFCD15098347

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

538.68

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.943

Distribution Coefficient, logD

4.943

Water Solubility, LogSw

-4.67

Polar Surface Area

61.706

Acid Dissociation Constant (pKa)

19.17

Base Dissociation Constant (pKb)

-0.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.80

K784-5979 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Cyclic Ugi PPI Library (9586 compounds)

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with K784-5979 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-5979?
Check Price and Availability of K784-5979, 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 K784-5979 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-5979
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-5979
  • 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 K784-5979 available by request