S229-0261 Screening compound: [1-benzyl-3-(dimethylamino)piperidin-4-yl]methanol
Chemical Structure Depiction of ChemDiv screening compound S229-0261
[1-benzyl-3-(dimethylamino)piperidin-4-yl]methanol
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
S229-0261
Molecular Formula
C15H24N2O (C15 H24 N2 O)
Compound Name
[1-benzyl-3-(dimethylamino)piperidin-4-yl]methanol
IUPAC name
[(3S4S)-1-benzyl-3-(dimethylamino)piperidin-4-yl]methanol
SMILES
CN(C)[C@@H]1[C@H](CO)CCN(Cc2ccccc2)C1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
248.37
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
1.246
Distribution Coefficient, logD
-0.546
Water Solubility, LogSw
-1.00
Polar Surface Area
22.931
Acid Dissociation Constant (pKa)
15.98
Base Dissociation Constant (pKb)
9.19
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
60.00
S229-0261 in Drug Discovery
Included in Screening Libraries
Bcl2-PPI Inhibitors Library (12246 compounds)
CNS BBB Library (22607 compounds)
Neurotransmitter Transporter Inhibitors Library (11024 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Ion Channels Focused Library (26372 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Included in 1.7M Stock Database
- Cancer
- Hemic and lymphatic
- Nervous system
- Nervous system
- Nervous system
- Nervous system
- Cardiovascular
- Cancer
- PPI modulators
- PPI modulators
- PPI modulators
- GPCR
- Ion Channels
- Ion Channels
- Cyclic compounds
References: we are preparing a list of scientific research reports with S229-0261 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)