8019-7738 Screening compound: 5-(3,4-diethoxyphenyl)-3-isoxazolecarboxylic acid
Chemical Structure Depiction of ChemDiv screening compound 8019-7738
5-(3,4-diethoxyphenyl)-3-isoxazolecarboxylic 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
8019-7738
Molecular Formula
C14H15NO5 (C14 H15 NO5)
Compound Name
5-(3,4-diethoxyphenyl)-3-isoxazolecarboxylic acid
IUPAC name
5-(34-diethoxyphenyl)-12-oxazole-3-carboxylic acid
SMILES
CCOc(ccc(-c1cc(C(O)=O)no1)c1)c1OCC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
277.28
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.037
Distribution Coefficient, logD
-3.193
Water Solubility, LogSw
-2.32
Polar Surface Area
64.602
Acid Dissociation Constant (pKa)
2.17
Base Dissociation Constant (pKb)
-7.40
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
28.57
8019-7738 in Drug Discovery
Included in Screening Libraries
Anti-Inflammatory Library (24602 compounds)
Antimitotic Tubulin Library (17355 compounds)
CORONAVIRUS Library (20774 compounds)
RAR (Nuclear receptors) Ligands Library (6524 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Antiviral
- Infections
- Immune system
- Cancer
- Respiratory tract
- Eye
- Male
- Female
- Hemic and lymphatic
- Congenital
- Skin
- Endocrine
- Immune system
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Cancer
- Digestive system
- Nervous system
- Female
- Metabolic
- Endocrine
- Nuclear receptors
- Phosphatases
- Phosphatases
- Receptor's ligands
- Receptor's ligands
References: we are preparing a list of scientific research reports with 8019-7738 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)