S069-4024 Screening compound: 3-(1-CYCLOBUTANECARBONYLPYRROLIDIN-3-YL)-5-CYCLOPROPYL-1,2,4-OXADIAZOLE
Chemical Structure Depiction of ChemDiv screening compound S069-4024
3-(1-CYCLOBUTANECARBONYLPYRROLIDIN-3-YL)-5-CYCLOPROPYL-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
S069-4024
Molecular Formula
C14H19N3O2 (C14 H19 N3 O2)
Compound Name
3-(1-CYCLOBUTANECARBONYLPYRROLIDIN-3-YL)-5-CYCLOPROPYL-1,2,4-OXADIAZOLE
IUPAC name
n/a
SMILES
O=C(C1CCC1)N(CC1)CC1c1noc(C2CC2)n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
261.32
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
2.110
Distribution Coefficient, logD
2.110
Water Solubility, LogSw
-1.99
Polar Surface Area
49.638
Acid Dissociation Constant (pKa)
23.36
Base Dissociation Constant (pKb)
0.17
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
78.57
S069-4024 in Drug Discovery
Included in Screening Libraries
3D-Fragment Library (4274 compounds)
Protein-Protein Interaction Library (218420 compounds)
Soluble Diversity Library (15920 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
MEF2-HDAC (class II) Modulators Library (5147 compounds)
Included in 1.7M Stock Database
- 3D
- Fragments
- Cyclic compounds
- PPI modulators
- PPI modulators
- Epigenetic
- Cancer
- Musculoskeletal
- Female
- Hemic and lymphatic
- Cardiovascular
References: we are preparing a list of scientific research reports with S069-4024 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)