S926-2036 Screening compound: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-{[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methoxy}piperidine
Chemical Structure Depiction of ChemDiv screening compound S926-2036
1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-{[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methoxy}piperidine
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
S926-2036
Molecular Formula
C15H22N4O6S (C15 H22 N4 O6 S)
Compound Name
1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-{[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]methoxy}piperidine
IUPAC name
1-[(35-dimethyl-12-oxazol-4-yl)sulfonyl]-3-{[5-(methoxymethyl)-124-oxadiazol-3-yl]methoxy}piperidine
SMILES
Cc1noc(C)c1S(N(CCC1)CC1OCc1noc(COC)n1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
386.43
Hydrogen Bond Acceptors Count
12.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
0.065
Distribution Coefficient, logD
0.065
Water Solubility, LogSw
-1.16
Polar Surface Area
101.691
Acid Dissociation Constant (pKa)
26.30
Base Dissociation Constant (pKb)
-2.26
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
66.67
S926-2036 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
CNS MPO Library (28609 compounds)
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
Alpha-Helix Mimetics Library (25899 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- Nervous system
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Mimetics
- Cyclic compounds
References: we are preparing a list of scientific research reports with S926-2036 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)