D479-0235 Screening compound: ethyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-1-carboxylate
Chemical Structure Depiction of ChemDiv screening compound D479-0235
ethyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-1-carboxylate
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
D479-0235
Molecular Formula
C11H12N2O3 (C11 H12 N2 O3)
Compound Name
ethyl 3-oxo-1,2,3,4-tetrahydroquinoxaline-1-carboxylate
IUPAC name
ethyl 3-oxo-1234-tetrahydroquinoxaline-1-carboxylate
SMILES
CCOC(N(C1)c(cccc2)c2NC1=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
220.23
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
1.455
Distribution Coefficient, logD
1.455
Water Solubility, LogSw
-2.23
Polar Surface Area
46.709
Acid Dissociation Constant (pKa)
11.23
Base Dissociation Constant (pKb)
-1.65
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
27.30
D479-0235 in Drug Discovery
Included in Screening Libraries
Cardiovascular Library (22201 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Proteases
- Epigenetic
References: we are preparing a list of scientific research reports with D479-0235 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)