0407-0108 Screening compound: 2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-4-one
Chemical Structure Depiction of ChemDiv screening compound 0407-0108
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-4-one
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
0407-0108
Molecular Formula
C15H12O7 (C15 H12 O7)
Compound Name
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-4-one
IUPAC name
2-(34-dihydroxyphenyl)-357-trihydroxy-34-dihydro-2H-1-benzopyran-4-one
SMILES
OC(C(c(cc1)cc(O)c1O)Oc1c2c(O)cc(O)c1)C2=O
InChI
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
304.26
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
5.00
Rotatable Bond Count
1.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
0.684
Distribution Coefficient, logD
0.636
Water Solubility, LogSw
-1.69
Polar Surface Area
103.488
Acid Dissociation Constant (pKa)
8.33
Base Dissociation Constant (pKb)
0.00
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
13.30
0407-0108 in Drug Discovery
Included in Screening Libraries
Antiviral HBV Library (10007 compounds)
CNS Annotated Library (688 compounds)
CORONAVIRUS Library (20774 compounds)
Frequent Hitters Library (7624 compounds)
Glucocorticoid receptors Library (4806 compounds)
Human GPCR Annotated Library (5539 compounds)
Human Transcription Factors Annotated Library (5098 compounds)
Launched & Clinically Evaluated Drugs Library (185 compounds)
PLpro Library (6343 compounds)
Targeted Diversity Library (40567 compounds)
Therapeutical Diversity Annotated Library (7563 compounds)
Aurora A-B Kinases Targeted Library (9426 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Natural Compounds Library (353 compounds)
New Agro Library (44492 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- Cancer
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Endocrine
- Antiviral
- Infections
- Immune system
- Cancer
- Digestive system
- Male
- Female
- Hemic and lymphatic
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Pool
- Nuclear receptors
- Kinases
- Phosphatases
- Receptor's ligands
- Agro
References: we are preparing a list of scientific research reports with 0407-0108 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)