1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi
TL;DR: 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi (CAS 158176-60-4) is a chemical compound with molecular formula C16H23NO and molecular weight 245.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1-(2-methylphenyl)-3-piperidin-1-ylpropan-1-one
Also Known As: Tolperisone Impurity 2, Tolperisone Impurity 6, 4'-Desmethyl 2'-Methyl Tolperisone, 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi, 1-Propanone, 1-(2-methylphenyl)-2-methyl-3-(1-piperidyl)-
| Molecular Formula | C16H23NO |
|---|---|
| Molecular Weight | 245.18 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.17796 |
| Heavy Atoms | 18 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 158176-60-4 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)C(C)CN2CCCCC2 |
| InChIKey | SLHURUNVGOQZCC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi (CAS 158176-60-4), with molecular formula C16H23NO and molecular weight 245.18 g/mol. IUPAC: 2-methyl-1-(2-methylphenyl)-3-piperidin-1-ylpropan-1-one.
Chemical Property Profile of 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi
Property Insights of 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi
The XLogP value of 3.4 indicates that 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi 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-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi?
The CAS number of 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi is 158176-60-4.
What is the molecular formula of 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi?
The molecular formula of 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi is C16H23NO.
What is the molecular weight of 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi?
The molecular weight of 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi is 245.18 g/mol.
Where can I buy 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi?
You can request a quote for 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 2-methyl-1-(2-methylphenyl)-3-(1-pi and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.