K286-0226 Screening compound: ethyl 4-(5-{[(diethylcarbamoyl)methyl]sulfanyl}-7-oxo-6-phenyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-3-yl)benzoate
Chemical Structure Depiction of ChemDiv screening compound K286-0226
ethyl 4-(5-{[(diethylcarbamoyl)methyl]sulfanyl}-7-oxo-6-phenyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-3-yl)benzoate
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
K286-0226
Molecular Formula
C26H26N4O4S3 (C26 H26 N4 O4 S3)
Compound Name
ethyl 4-(5-{[(diethylcarbamoyl)methyl]sulfanyl}-7-oxo-6-phenyl-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-3-yl)benzoate
IUPAC name
ethyl 4-(5-{[(diethylcarbamoyl)methyl]sulfanyl}-7-oxo-6-phenyl-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-3-yl)benzoate
SMILES
CCN(CC)C(CSC(N(c1ccccc1)C1=O)=NC(N2c(cc3)ccc3C(OCC)=O)=C1SC2=S)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
554.72
Hydrogen Bond Acceptors Count
12.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
11.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
4.531
Distribution Coefficient, logD
4.531
Water Solubility, LogSw
-4.22
Polar Surface Area
63.384
Acid Dissociation Constant (pKa)
30.10
Base Dissociation Constant (pKb)
1.00
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
26.90
K286-0226 in Drug Discovery
Included in Screening Libraries
C-Met Library (15277 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Endocrine
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- Kinases
- GPCR
- Receptor's ligands
- Receptor's ligands
References: we are preparing a list of scientific research reports with K286-0226 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)