H025-4101C Screening compound: 1-{3-[3-(4-chlorophenyl)propoxy]propyl}piperidine
Chemical Structure Depiction of ChemDiv screening compound H025-4101C
1-{3-[3-(4-chlorophenyl)propoxy]propyl}piperidine
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
H025-4101C
Molecular Formula
C17H26ClNO (C17 H26 ClNO)
Compound Name
1-{3-[3-(4-chlorophenyl)propoxy]propyl}piperidine
IUPAC name
1-{3-[3-(4-chlorophenyl)propoxy]propyl}piperidine
SMILES
Clc1ccc(CCCOCCCN2CCCCC2)cc1
InChI
InChI Key
Chemical and Physical Properties
Saltdata
HCl
Molecular Weight
295.85
Hydrogen Bond Acceptors Count
2.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
2
Partition Coefficient, logP
4.257
Distribution Coefficient, logD
1.876
Water Solubility, LogSw
-4.42
Polar Surface Area
12.221
Acid Dissociation Constant (pKa)
26.63
Base Dissociation Constant (pKb)
9.78
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
64.71
H025-4101C in Drug Discovery
Included in Screening Libraries
CNS Annotated Library (688 compounds)
Human GPCR Annotated Library (5539 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with H025-4101C 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)