K784-6600 Screening compound: 1-cycloheptyl-4-[(furan-2-yl)methyl]-3-(3-methoxy-4-propoxyphenyl)piperazine-2,5-dione
Chemical Structure Depiction of ChemDiv screening compound K784-6600
1-cycloheptyl-4-[(furan-2-yl)methyl]-3-(3-methoxy-4-propoxyphenyl)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
K784-6600
Molecular Formula
C26H34N2O5 (C26 H34 N2 O5)
Compound Name
1-cycloheptyl-4-[(furan-2-yl)methyl]-3-(3-methoxy-4-propoxyphenyl)piperazine-2,5-dione
IUPAC name
1-cycloheptyl-4-[(furan-2-yl)methyl]-3-(3-methoxy-4-propoxyphenyl)piperazine-25-dione
SMILES
CCCOc(ccc(C(C(N(C1)C2CCCCCC2)=O)N(Cc2ccco2)C1=O)c1)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
454.57
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.707
Distribution Coefficient, logD
4.707
Water Solubility, LogSw
-4.51
Polar Surface Area
55.162
Acid Dissociation Constant (pKa)
19.83
Base Dissociation Constant (pKb)
-0.94
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
53.80
K784-6600 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
- 3D
- Cyclic compounds
- PPI modulators
- PPI modulators
References: we are preparing a list of scientific research reports with K784-6600 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)