T742-0292 Screening compound: 5-(3-chlorophenyl)-3-[(2-ethyl-1H-imidazol-1-yl)methyl]-1,2,4-oxadiazole
Chemical Structure Depiction of ChemDiv screening compound T742-0292
5-(3-chlorophenyl)-3-[(2-ethyl-1H-imidazol-1-yl)methyl]-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
T742-0292
Molecular Formula
C14H13ClN4O (C14 H13 ClN4 O)
Compound Name
5-(3-chlorophenyl)-3-[(2-ethyl-1H-imidazol-1-yl)methyl]-1,2,4-oxadiazole
IUPAC name
5-(3-chlorophenyl)-3-[(2-ethyl-1H-imidazol-1-yl)methyl]-124-oxadiazole
SMILES
CCc1nccn1Cc1noc(-c2cccc(Cl)c2)n1
InChI
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
288.74
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
2.961
Distribution Coefficient, logD
0.011
Water Solubility, LogSw
-3.37
Polar Surface Area
45.392
Acid Dissociation Constant (pKa)
28.99
Base Dissociation Constant (pKb)
10.35
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
21.40
T742-0292 in Drug Discovery
Included in Screening Libraries
CNS BBB Library (22607 compounds)
SmartTM Library (51161 compounds)
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- Others
References: we are preparing a list of scientific research reports with T742-0292 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)