E209-1175 Screening compound: 1-[(2-chloro-6-fluorophenyl)methyl]-4-(3,4-difluorophenyl)-1,2,3,4-tetrahydropyrazine-2,3-dione
Chemical Structure Depiction of ChemDiv screening compound E209-1175
1-[(2-chloro-6-fluorophenyl)methyl]-4-(3,4-difluorophenyl)-1,2,3,4-tetrahydropyrazine-2,3-dione
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
E209-1175
Molecular Formula
C17H10ClF3N2O2 (C17 H10 ClF3 N2 O2)
Compound Name
1-[(2-chloro-6-fluorophenyl)methyl]-4-(3,4-difluorophenyl)-1,2,3,4-tetrahydropyrazine-2,3-dione
IUPAC name
1-[(2-chloro-6-fluorophenyl)methyl]-4-(34-difluorophenyl)-1234-tetrahydropyrazine-23-dione
SMILES
O=C1N(Cc(c(F)ccc2)c2Cl)C=CN(c(cc2)cc(F)c2F)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
366.73
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
2.661
Distribution Coefficient, logD
2.661
Water Solubility, LogSw
-3.31
Polar Surface Area
31.029
Acid Dissociation Constant (pKa)
30.26
Base Dissociation Constant (pKb)
-0.24
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
5.90
E209-1175 in Drug Discovery
Included in Screening Libraries
Anti-Inflammatory Library (24602 compounds)
Anticancer Library (62698 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
Included in 1.7M Stock Database
- Immune system
- Cancer
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Epigenetic
References: we are preparing a list of scientific research reports with E209-1175 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)