P425-0566 Screening compound: N-{[4-(trifluoromethyl)phenyl]methyl}-5H,6H,7H,8H-imidazo[1,2-a]pyridine-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound P425-0566
N-{[4-(trifluoromethyl)phenyl]methyl}-5H,6H,7H,8H-imidazo[1,2-a]pyridine-2-carboxamide
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
P425-0566
Molecular Formula
C16H16F3N3O (C16 H16 F3 N3 O)
Compound Name
N-{[4-(trifluoromethyl)phenyl]methyl}-5H,6H,7H,8H-imidazo[1,2-a]pyridine-2-carboxamide
IUPAC name
N-{[4-(trifluoromethyl)phenyl]methyl}-5H6H7H8H-imidazo[12-a]pyridine-2-carboxamide
SMILES
O=C(c1cn(CCCC2)c2n1)NCc1ccc(C(F)(F)F)cc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
323.32
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
2.727
Distribution Coefficient, logD
2.727
Water Solubility, LogSw
-3.10
Polar Surface Area
37.527
Acid Dissociation Constant (pKa)
12.69
Base Dissociation Constant (pKb)
4.14
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
37.50
P425-0566 in Drug Discovery
Included in Screening Libraries
CNS BBB Library (22607 compounds)
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Ion Channels Focused Library (26372 compounds)
Included in 1.7M Stock Database
- Nervous system
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- Nervous system
- Cardiovascular
- PPI modulators
- Cyclic compounds
- Others
- Ion Channels
References: we are preparing a list of scientific research reports with P425-0566 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)