RefChem:335428
TL;DR: RefChem:335428 (CAS 14991-98-1) is a chemical compound with molecular formula C21H26ClNO2 and molecular weight 359.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[4-(3-morpholin-4-ylprop-1-ynyl)phenyl]ethynyl]cyclohexan-1-ol;hydrochloride
Also Known As: Cyclohexanol, 1-((4-(3-(4-morpholinyl)-1-propynyl)phenyl)ethynyl)-, hydrochloride, 1-((4-(3-(4-Morpholinyl)-1-propynyl)phenyl)ethynyl)cyclohexanol hydrochloride, 1-[2-[4-(3-morpholin-4-ylprop-1-ynyl)phenyl]ethynyl]cyclohexan-1-ol hydrochloride, 1-({4-[3-(Morpholin-4-yl)prop-1-yn-1-yl]phenyl}ethynyl)cyclohexan-1-ol--hydrogen chloride (1/1), RefChem:335428
| Molecular Formula | C21H26ClNO2 |
|---|---|
| Molecular Weight | 359.17 g/mol |
| LogP | 2.8388 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.1652 |
| Heavy Atoms | 25 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 14991-98-1 |
|---|---|
| SMILES | C1CCC(CC1)(C#CC2=CC=C(C=C2)C#CCN3CCOCC3)O.Cl |
| InChIKey | WIGZYYVIEJCVLN-UHFFFAOYSA-N |
Product Overview
RefChem:335428 (CAS 14991-98-1), with molecular formula C21H26ClNO2 and molecular weight 359.17 g/mol. IUPAC: 1-[2-[4-(3-morpholin-4-ylprop-1-ynyl)phenyl]ethynyl]cyclohexan-1-ol;hydrochloride.
Chemical Property Profile of RefChem:335428
Property Insights of RefChem:335428
The XLogP value of 2.8388 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:335428. With a topological polar surface area (TPSA) of 32.7 Ų, RefChem:335428 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:335428 has 2 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 RefChem:335428?
The CAS number of RefChem:335428 is 14991-98-1.
What is the molecular formula of RefChem:335428?
The molecular formula of RefChem:335428 is C21H26ClNO2.
What is the molecular weight of RefChem:335428?
The molecular weight of RefChem:335428 is 359.17 g/mol.
Where can I buy RefChem:335428?
You can request a quote for RefChem:335428 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:335428?
Yes, KEHONG BIO provides custom synthesis services for RefChem:335428 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.