S343-0149 Screening compound: 1-(3-chloro-4-fluorophenyl)-4-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-2-one
Chemical Structure Depiction of ChemDiv screening compound S343-0149
1-(3-chloro-4-fluorophenyl)-4-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-2-one
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
S343-0149
Molecular Formula
C18H12ClF2N3O2 (C18 H12 ClF2 N3 O2)
Compound Name
1-(3-chloro-4-fluorophenyl)-4-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-2-one
IUPAC name
1-(3-chloro-4-fluorophenyl)-4-[5-(4-fluorophenyl)-124-oxadiazol-3-yl]pyrrolidin-2-one
SMILES
O=C(CC(C1)c2noc(-c(cc3)ccc3F)n2)N1c(cc1)cc(Cl)c1F
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
375.76
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.041
Distribution Coefficient, logD
4.041
Water Solubility, LogSw
-4.43
Polar Surface Area
48.394
Acid Dissociation Constant (pKa)
11.48
Base Dissociation Constant (pKb)
-3.82
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
16.70
S343-0149 in Drug Discovery
Included in Screening Libraries
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
MEF2-HDAC (class II) Modulators Library (5147 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- PPI modulators
- Epigenetic
- PPI modulators
- Mimetics
- Cyclic compounds
- Mimetics
- Cancer
- Musculoskeletal
- Female
- Hemic and lymphatic
- Cardiovascular
References: we are preparing a list of scientific research reports with S343-0149 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)