M747-3085 Screening compound: 4-{2-[1-(1-ethyl-1H-pyrazole-5-carbonyl)piperidin-4-yl]ethoxy}pyridine
Chemical Structure Depiction of ChemDiv screening compound M747-3085
4-{2-[1-(1-ethyl-1H-pyrazole-5-carbonyl)piperidin-4-yl]ethoxy}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
M747-3085
Molecular Formula
C18H24N4O2 (C18 H24 N4 O2)
Compound Name
4-{2-[1-(1-ethyl-1H-pyrazole-5-carbonyl)piperidin-4-yl]ethoxy}pyridine
IUPAC name
4-{2-[1-(1-ethyl-1H-pyrazole-5-carbonyl)piperidin-4-yl]ethoxy}pyridine
SMILES
CCn1nccc1C(N1CCC(CCOc2ccncc2)CC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
328.41
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
1.644
Distribution Coefficient, logD
1.643
Water Solubility, LogSw
-1.43
Polar Surface Area
46.550
Acid Dissociation Constant (pKa)
25.88
Base Dissociation Constant (pKb)
4.11
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
50.00
M747-3085 in Drug Discovery
Included in Screening Libraries
GPCR Targeted Library (31838 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- GPCR
- Others
- Receptor's ligands
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with M747-3085 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)