S229-0187 Screening compound: [3-(dimethylamino)-1-[(2-ethoxyphenyl)methyl]piperidin-4-yl]methanol
Chemical Structure Depiction of ChemDiv screening compound S229-0187
[3-(dimethylamino)-1-[(2-ethoxyphenyl)methyl]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
S229-0187
Molecular Formula
C17H28N2O2 (C17 H28 N2 O2)
Compound Name
[3-(dimethylamino)-1-[(2-ethoxyphenyl)methyl]piperidin-4-yl]methanol
IUPAC name
[(3S4S)-3-(dimethylamino)-1-[(2-ethoxyphenyl)methyl]piperidin-4-yl]methanol
SMILES
CCOc1c(CN(CC[C@H]2CO)C[C@@H]2N(C)C)cccc1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
292.42
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
1.740
Distribution Coefficient, logD
-0.052
Water Solubility, LogSw
-1.89
Polar Surface Area
30.141
Acid Dissociation Constant (pKa)
15.98
Base Dissociation Constant (pKb)
9.19
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
64.70
S229-0187 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
Bcl2-PPI Inhibitors Library (12246 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Cancer
- Hemic and lymphatic
- Cancer
- PPI modulators
- PPI modulators
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with S229-0187 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of S229-0187, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
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)