K784-7858 Screening compound: 2-{[5,6-bis(4-ethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of ChemDiv screening compound K784-7858
2-{[5,6-bis(4-ethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
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
K784-7858
Molecular Formula
C29H30N4O3S (C29 H30 N4 O3 S)
Compound Name
2-{[5,6-bis(4-ethoxyphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
IUPAC name
2-{[56-bis(4-ethoxyphenyl)-124-triazin-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
SMILES
CCOc(cc1)ccc1-c1nc(SCC(NCCc2ccccc2)=O)nnc1-c(cc1)ccc1OCC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
514.65
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
13.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.827
Distribution Coefficient, logD
4.827
Water Solubility, LogSw
-4.47
Polar Surface Area
69.945
Acid Dissociation Constant (pKa)
14.66
Base Dissociation Constant (pKb)
3.91
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
24.10
K784-7858 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Eccentric PPI Library (11937 compounds)
MCL1 Targeted Library (12200 compounds)
Protein-Protein Interaction Library (218420 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Cyclic compounds
- PPI modulators
- PPI modulators
- Epigenetic
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Phosphatases
References: we are preparing a list of scientific research reports with K784-7858 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)