P200-0157 Screening compound: 5-[(2-ethyl-1H-imidazol-1-yl)methyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of ChemDiv screening compound P200-0157
5-[(2-ethyl-1H-imidazol-1-yl)methyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole
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
P200-0157
Molecular Formula
C14H13FN4O (C14 H13 FN4 O)
Compound Name
5-[(2-ethyl-1H-imidazol-1-yl)methyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole
IUPAC name
5-[(2-ethyl-1H-imidazol-1-yl)methyl]-3-(4-fluorophenyl)-124-oxadiazole
SMILES
CCc1nccn1Cc1nc(-c(cc2)ccc2F)no1
InChI
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
272.28
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.819
Distribution Coefficient, logD
0.750
Water Solubility, LogSw
-2.95
Polar Surface Area
44.067
Acid Dissociation Constant (pKa)
25.92
Base Dissociation Constant (pKb)
9.47
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
21.40
P200-0157 in Drug Discovery
Included in Screening Libraries
CNS BBB Library (22607 compounds)
SmartTM Library (51161 compounds)
Ion Channels Focused Library (26372 compounds)
Included in 1.7M Stock Database
- Nervous system
- Nervous system
- Cardiovascular
- Ion Channels
References: we are preparing a list of scientific research reports with P200-0157 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)