T619-4843 Screening compound: 2-methyl-5-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl}pyridine
Chemical Structure Depiction of ChemDiv screening compound T619-4843
2-methyl-5-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl}pyridine
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
T619-4843
Molecular Formula
C19H19N5O2 (C19 H19 N5 O2)
Compound Name
2-methyl-5-{2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl}pyridine
IUPAC name
2-methyl-5-{2-[3-(pyridin-3-yl)-124-oxadiazol-5-yl]piperidine-1-carbonyl}pyridine
SMILES
Cc(cc1)ncc1C(N(CCCC1)C1c1nc(-c2cnccc2)no1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
349.39
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.416
Distribution Coefficient, logD
1.777
Water Solubility, LogSw
-1.90
Polar Surface Area
66.448
Acid Dissociation Constant (pKa)
25.64
Base Dissociation Constant (pKb)
7.93
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
31.60
T619-4843 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
GPCR Targeted Library (31838 compounds)
Protein-Protein Interaction Library (218420 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
- Nervous system
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Cancer
- GPCR
- Receptor's ligands
- PPI modulators
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with T619-4843 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)