L948-1531 Screening compound: 5-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-3-(3-methylphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of ChemDiv screening compound L948-1531
5-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-3-(3-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
L948-1531
Molecular Formula
C22H23N3O4 (C22 H23 N3 O4)
Compound Name
5-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-3-(3-methylphenyl)-1,2,4-oxadiazole
IUPAC name
5-[1-(34-dimethoxybenzoyl)pyrrolidin-2-yl]-3-(3-methylphenyl)-124-oxadiazole
SMILES
Cc1cccc(-c2noc(C(CCC3)N3C(c(cc3)cc(OC)c3OC)=O)n2)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
393.44
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.911
Distribution Coefficient, logD
3.911
Water Solubility, LogSw
-3.97
Polar Surface Area
63.613
Acid Dissociation Constant (pKa)
25.80
Base Dissociation Constant (pKb)
-5.80
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
31.80
L948-1531 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 L948-1531 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)