T619-4903 Screening compound: 1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of ChemDiv screening compound T619-4903
1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-(thiophen-2-yl)ethan-1-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
T619-4903
Molecular Formula
C18H18N4O2S (C18 H18 N4 O2 S)
Compound Name
1-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-(thiophen-2-yl)ethan-1-one
IUPAC name
1-{2-[3-(pyridin-3-yl)-124-oxadiazol-5-yl]piperidin-1-yl}-2-(thiophen-2-yl)ethan-1-one
SMILES
O=C(Cc1cccs1)N(CCCC1)C1c1nc(-c2cnccc2)no1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
354.43
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.705
Distribution Coefficient, logD
2.067
Water Solubility, LogSw
-2.50
Polar Surface Area
57.995
Acid Dissociation Constant (pKa)
22.63
Base Dissociation Constant (pKb)
7.93
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
33.30
T619-4903 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with T619-4903 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)