RefChem:1057785
TL;DR: RefChem:1057785 (CAS 139193-90-1) is a chemical compound with molecular formula C20H27ClN2O2 and molecular weight 362.17612 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(E)-2-[2-[2-(azepan-1-yl)ethoxy]phenyl]ethenyl]-3-methyl-1,2-oxazole;hydrochloride
Also Known As: 1H-Azepine, hexahydro-1-(2-(2-(2-(3-methyl-5-isoxazolyl)ethenyl)phenoxy)ethyl)-, monohydrochloride, (E)-, 1-[2-[2-[(E)-2-(3-methyl-1,2-oxazol-5-yl)ethenyl]phenoxy]ethyl]azepane Hydrochloride, 5-[(E)-2-[2-[2-(azepan-1-yl)ethoxy]phenyl]ethenyl]-3-methyl-1,2-oxazole hydrochloride
Technical Specifications
| Molecular Formula | C20H27ClN2O2 |
| Molecular Weight | 362.17612 g/mol |
| XLogP | 4.83002 |
| Topological Polar Surface Area (TPSA) | 38.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.17612 Da |
| Heavy Atoms | 25 |
| Complexity | 380.0 |
| SMILES | CC1=NOC(=C1)/C=C/C2=CC=CC=C2OCCN3CCCCCC3.Cl |
| InChIKey | SVZYXFNXKGAXNO-ASTDGNLGSA-N |
Chemical Property Profile of RefChem:1057785
Property Insights of RefChem:1057785
The XLogP value of 4.83002 indicates that RefChem:1057785 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.5 Ų, RefChem:1057785 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1057785 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1057785?
The CAS number of RefChem:1057785 is 139193-90-1.
What is the molecular formula of RefChem:1057785?
The molecular formula of RefChem:1057785 is C20H27ClN2O2.
What is the molecular weight of RefChem:1057785?
The molecular weight of RefChem:1057785 is 362.17612 g/mol.
Where can I buy RefChem:1057785?
You can request a quote for RefChem:1057785 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1057785?
Yes, CoreyChem provides custom synthesis services for RefChem:1057785 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.