Y040-6895 Screening compound: 2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetic acid
Chemical Structure Depiction of ChemDiv screening compound Y040-6895
2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetic acid
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
Y040-6895
Molecular Formula
C17H12O6 (C17 H12 O6)
Compound Name
2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetic acid
IUPAC name
2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetic acid
SMILES
OC(COc(cc1O)cc(OC(c2ccccc2)=C2)c1C2=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
312.28
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.374
Distribution Coefficient, logD
-0.863
Water Solubility, LogSw
-3.55
Polar Surface Area
74.216
Acid Dissociation Constant (pKa)
3.16
Base Dissociation Constant (pKb)
0.00
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
5.90
Y040-6895 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
Anti-Inflammatory Library (24602 compounds)
Antimitotic Tubulin Library (17355 compounds)
STING Agonist Library (5895 compounds)
Therapeutical Diversity Annotated Library (7563 compounds)
Aurora A-B Kinases Targeted Library (9426 compounds)
Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Eye
- Cancer
- Immune system
- Cancer
- Digestive system
- Male
- Female
- Hemic and lymphatic
- Cancer
- Digestive system
- Nervous system
- Female
- Metabolic
- Endocrine
- Epigenetic
- Receptor's ligands
- Receptor's ligands
- GPCR
- Ion Channels
- Others
- Kinases
- Phosphatases
References: we are preparing a list of scientific research reports with Y040-6895 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)