1-Phenyl-3-piperidin-1-yl-propan-1,3-dion
TL;DR: 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion (CAS 58792-29-3) is a chemical compound with molecular formula C14H17NO2 and molecular weight 231.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-piperidin-1-ylpropane-1,3-dione
Also Known As: 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion, 1-phenyl-3-(piperidin-1-yl)propane-1,3-dione, 1-phenyl-3-piperidin-1-ylpropane-1,3-dione, 1-phenyl-3-piperidino-1,3-propanedione, 1-Phenyl-3-piperidinopropane-1,3-dione
| Molecular Formula | C14H17NO2 |
|---|---|
| Molecular Weight | 231.13 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.12593 |
| Heavy Atoms | 17 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 58792-29-3 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)CC(=O)C2=CC=CC=C2 |
| InChIKey | WYONJHQETBNPEB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenyl-3-piperidin-1-yl-propan-1,3-dion (CAS 58792-29-3), with molecular formula C14H17NO2 and molecular weight 231.13 g/mol. IUPAC: 1-phenyl-3-piperidin-1-ylpropane-1,3-dione.
Chemical Property Profile of 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion
Property Insights of 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion. With a topological polar surface area (TPSA) of 37.4 Ų, 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion?
The CAS number of 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion is 58792-29-3.
What is the molecular formula of 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion?
The molecular formula of 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion is C14H17NO2.
What is the molecular weight of 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion?
The molecular weight of 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion is 231.13 g/mol.
Where can I buy 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion?
You can request a quote for 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3-piperidin-1-yl-propan-1,3-dion and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.