L948-0755 Screening compound: 5-[1-(3,5-dimethylbenzoyl)pyrrolidin-2-yl]-3-(2-methylphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of ChemDiv screening compound L948-0755
5-[1-(3,5-dimethylbenzoyl)pyrrolidin-2-yl]-3-(2-methylphenyl)-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
L948-0755
Molecular Formula
C22H23N3O2 (C22 H23 N3 O2)
Compound Name
5-[1-(3,5-dimethylbenzoyl)pyrrolidin-2-yl]-3-(2-methylphenyl)-1,2,4-oxadiazole
IUPAC name
5-[1-(35-dimethylbenzoyl)pyrrolidin-2-yl]-3-(2-methylphenyl)-124-oxadiazole
SMILES
Cc1cc(C(N(CCC2)C2c2nc(-c3c(C)cccc3)no2)=O)cc(C)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
361.44
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.804
Distribution Coefficient, logD
4.804
Water Solubility, LogSw
-4.58
Polar Surface Area
48.352
Acid Dissociation Constant (pKa)
25.80
Base Dissociation Constant (pKb)
-7.01
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
31.80
L948-0755 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
SmartTM Library (51161 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Cancer
- Proteases
- Cyclic compounds
References: we are preparing a list of scientific research reports with L948-0755 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)