F834-0064 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-[5-methyl-4-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-3H,4H-thieno[2,3-d]pyrimidin-3-yl]acetamide
Chemical Structure Depiction of ChemDiv screening compound F834-0064
N-(2H-1,3-benzodioxol-5-yl)-2-[5-methyl-4-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-3H,4H-thieno[2,3-d]pyrimidin-3-yl]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
F834-0064
Molecular Formula
C24H17N5O5S (C24 H17 N5 O5 S)
Compound Name
N-(2H-1,3-benzodioxol-5-yl)-2-[5-methyl-4-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-3H,4H-thieno[2,3-d]pyrimidin-3-yl]acetamide
IUPAC name
N-(2H-13-benzodioxol-5-yl)-2-[5-methyl-4-oxo-6-(3-phenyl-124-oxadiazol-5-yl)-3H4H-thieno[23-d]pyrimidin-3-yl]acetamide
SMILES
Cc1c(-c2nc(-c3ccccc3)no2)sc(N=CN2CC(Nc(cc3)cc4c3OCO4)=O)c1C2=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
487.5
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
4.050
Distribution Coefficient, logD
4.050
Water Solubility, LogSw
-4.23
Polar Surface Area
97.912
Acid Dissociation Constant (pKa)
11.63
Base Dissociation Constant (pKb)
1.00
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
12.50
F834-0064 in Drug Discovery
Included in Screening Libraries
Angiogenesis library (14822 compounds)
Anticancer Library (62698 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Cancer
- Cancer
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- Kinases
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with F834-0064 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)