RefChem:1082531
TL;DR: RefChem:1082531 (CAS 2269-28-5) is a chemical compound with molecular formula C21H30ClNO and molecular weight 347.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-1-phenyl-4-piperidin-1-ylbut-2-yn-1-ol;hydrochloride
Also Known As: alpha-Phenyl-alpha-(3-piperidino-1-propynyl)cyclohexanemethanol hydrochloride, 1-cyclohexyl-1-phenyl-4-piperidin-1-ylbut-2-yn-1-ol;hydrochloride, Cyclohexanemethanol, alpha-phenyl-alpha-(3-piperidino-1-propynyl)-, hydrochloride, 1-cyclohexyl-1-phenyl-4-piperidin-1-ylbut-2-yn-1-ol,hydrochl, 1-cyclohexyl-1-phenyl-4-piperidin-1-ylbut-2-yn-1-ol hydrochloride
| Molecular Formula | C21H30ClNO |
|---|---|
| Molecular Weight | 347.20 g/mol |
| LogP | 4.3656 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.2016 |
| Heavy Atoms | 24 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 2269-28-5 |
|---|---|
| SMILES | C1CCC(CC1)C(C#CCN2CCCCC2)(C3=CC=CC=C3)O.Cl |
| InChIKey | DDDZHYDNTOHYMB-UHFFFAOYSA-N |
Product Overview
RefChem:1082531 (CAS 2269-28-5), with molecular formula C21H30ClNO and molecular weight 347.20 g/mol. IUPAC: 1-cyclohexyl-1-phenyl-4-piperidin-1-ylbut-2-yn-1-ol;hydrochloride.
Chemical Property Profile of RefChem:1082531
Property Insights of RefChem:1082531
The XLogP value of 4.3656 indicates that RefChem:1082531 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, RefChem:1082531 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1082531 has 2 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 RefChem:1082531?
The CAS number of RefChem:1082531 is 2269-28-5.
What is the molecular formula of RefChem:1082531?
The molecular formula of RefChem:1082531 is C21H30ClNO.
What is the molecular weight of RefChem:1082531?
The molecular weight of RefChem:1082531 is 347.20 g/mol.
Where can I buy RefChem:1082531?
You can request a quote for RefChem:1082531 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1082531?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1082531 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.