5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol
TL;DR: 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol (CAS 487012-67-9) is a chemical compound with molecular formula C17H23NO and molecular weight 257.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(azepan-1-yl)-2-phenylpent-3-yn-2-ol
Also Known As: 5-(azepan-1-yl)-2-phenylpent-3-yn-2-ol, BAS 03391886, 5-Azepan-1-yl-2-phenyl-pent-3-yn-2-ol, AB00119700-01
| Molecular Formula | C17H23NO |
|---|---|
| Molecular Weight | 257.18 g/mol |
| LogP | 2.7735 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.17798 |
| Heavy Atoms | 19 |
| Complexity | 433.325 |
Chemical Identifiers
| CAS Number | 487012-67-9 |
|---|---|
| SMILES | CC(C#CCN1CCCCCC1)(C2=CC=CC=C2)O |
Product Overview
5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol (CAS 487012-67-9), with molecular formula C17H23NO and molecular weight 257.18 g/mol. IUPAC: 5-(azepan-1-yl)-2-phenylpent-3-yn-2-ol.
Chemical Property Profile of 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol
Property Insights of 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol
The XLogP value of 2.7735 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol. With a topological polar surface area (TPSA) of 23.47 Ų, 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol has 1 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 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol?
The CAS number of 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol is 487012-67-9.
What is the molecular formula of 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol?
The molecular formula of 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol is C17H23NO.
What is the molecular weight of 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol?
The molecular weight of 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol is 257.18 g/mol.
Where can I buy 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol?
You can request a quote for 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 5-(Azepan-1-yl)-2-phenylpent-3-yn-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.