L457-0175 Screening compound: N-[(2-fluorophenyl)methyl]-1-(pyridin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound L457-0175
N-[(2-fluorophenyl)methyl]-1-(pyridin-4-yl)piperidine-4-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
L457-0175
Molecular Formula
C18H20FN3O (C18 H20 FN3 O)
Compound Name
N-[(2-fluorophenyl)methyl]-1-(pyridin-4-yl)piperidine-4-carboxamide
IUPAC name
N-[(2-fluorophenyl)methyl]-1-(pyridin-4-yl)piperidine-4-carboxamide
SMILES
O=C(C(CC1)CCN1c1ccncc1)NCc(cccc1)c1F
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
313.37
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.262
Distribution Coefficient, logD
1.658
Water Solubility, LogSw
-2.25
Polar Surface Area
37.532
Acid Dissociation Constant (pKa)
12.56
Base Dissociation Constant (pKb)
7.88
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
33.30
L457-0175 in Drug Discovery
Included in Screening Libraries
CNS BBB Library (22607 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
Protein-Protein Interaction Library (218420 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
- Hemic and lymphatic
- Cardiovascular
- 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 L457-0175 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)