6228-2575 Screening compound: 2-(piperidin-1-yl)ethyl 4-[(4-ethoxyphenoxy)methyl]benzoate
Chemical Structure Depiction of ChemDiv screening compound 6228-2575
2-(piperidin-1-yl)ethyl 4-[(4-ethoxyphenoxy)methyl]benzoate
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
6228-2575
Molecular Formula
C23H29NO4 (C23 H29 NO4)
Compound Name
2-(piperidin-1-yl)ethyl 4-[(4-ethoxyphenoxy)methyl]benzoate
IUPAC name
2-(piperidin-1-yl)ethyl 4-[(4-ethoxyphenoxy)methyl]benzoate
SMILES
CCOc(cc1)ccc1OCc(cc1)ccc1C(OCCN1CCCCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
383.49
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.856
Distribution Coefficient, logD
3.998
Water Solubility, LogSw
-4.55
Polar Surface Area
39.348
Acid Dissociation Constant (pKa)
28.05
Base Dissociation Constant (pKb)
8.19
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
43.50
6228-2575 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Neurotransmitter Transporter Inhibitors Library (11024 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Included in 1.7M Stock Database
- Nervous system
- Nervous system
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- GPCR
- Ion Channels
- Proteases
References: we are preparing a list of scientific research reports with 6228-2575 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)