1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate
TL;DR: 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate (CAS 78219-31-5) is a chemical compound with molecular formula C19H29NO2 and molecular weight 303.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-butylpiperidin-2-yl)propan-2-yl benzoate
Also Known As: 1-(1-butylpiperidin-2-yl)propan-2-yl benzoate, 2-Piperidineethanol, 1-butyl-alpha-methyl-, benzoate, Benzoic acid, 2-(2-N-butylpiperidyl)isopropyl ester, 1-Butyl-alpha-methyl-2-piperidineethanol benzoate, 2-Piperidineethanol, 1-butyl-.alpha.-methyl-, benzoate (ester)
| Molecular Formula | C19H29NO2 |
|---|---|
| Molecular Weight | 303.22 g/mol |
| LogP | 4.2766 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 303.21982 |
| Heavy Atoms | 22 |
| Complexity | 446.0082 |
Chemical Identifiers
| CAS Number | 78219-31-5 |
|---|---|
| SMILES | CCCCN1CCCCC1CC(C)OC(=O)C2=CC=CC=C2 |
Product Overview
1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate (CAS 78219-31-5), with molecular formula C19H29NO2 and molecular weight 303.22 g/mol. IUPAC: 1-(1-butylpiperidin-2-yl)propan-2-yl benzoate.
Chemical Property Profile of 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate
Property Insights of 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate
The XLogP value of 4.2766 indicates that 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate has 0 hydrogen bond donor(s) and 3 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-(1-Butylpiperidin-2-yl)propan-2-yl benzoate?
The CAS number of 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate is 78219-31-5.
What is the molecular formula of 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate?
The molecular formula of 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate is C19H29NO2.
What is the molecular weight of 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate?
The molecular weight of 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate is 303.22 g/mol.
Where can I buy 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate?
You can request a quote for 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Butylpiperidin-2-yl)propan-2-yl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.