RefChem:1066543
TL;DR: RefChem:1066543 (CAS 21165-51-5) is a chemical compound with molecular formula C18H22ClNO and molecular weight 303.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxyphenyl)-N,N-dimethyl-3-phenylprop-2-en-1-amine;hydrochloride
Also Known As: 1-ethoxy-1-phenylpropanone, 1-(o-Anisyl)-1-phenyl-3-dimethylaminoprop-1-ene hydrochloride, 2-Propen-1-amine, 3-(o-anisyl)-N,N-dimethyl-3-phenyl-, hydrochloride, Propene, 3-dimethylamino-1-(2-methoxyphenyl)-1-phenyl-, hydrochloride, 2-Propen-1-amine, N,N-dimethyl-3-(o-methoxyphenyl)-3-phenyl-, hydrochloride
| Molecular Formula | C18H22ClNO |
|---|---|
| Molecular Weight | 303.14 g/mol |
| LogP | 4.11 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.13898 |
| Heavy Atoms | 21 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 21165-51-5 |
|---|---|
| SMILES | CN(C)CC=C(C1=CC=CC=C1)C2=CC=CC=C2OC.Cl |
| InChIKey | QYOYUQUNULCUIG-UHFFFAOYSA-N |
Product Overview
RefChem:1066543 (CAS 21165-51-5), with molecular formula C18H22ClNO and molecular weight 303.14 g/mol. IUPAC: 3-(2-methoxyphenyl)-N,N-dimethyl-3-phenylprop-2-en-1-amine;hydrochloride.
Chemical Property Profile of RefChem:1066543
Property Insights of RefChem:1066543
The XLogP value of 4.11 indicates that RefChem:1066543 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, RefChem:1066543 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1066543 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 RefChem:1066543?
The CAS number of RefChem:1066543 is 21165-51-5.
What is the molecular formula of RefChem:1066543?
The molecular formula of RefChem:1066543 is C18H22ClNO.
What is the molecular weight of RefChem:1066543?
The molecular weight of RefChem:1066543 is 303.14 g/mol.
Where can I buy RefChem:1066543?
You can request a quote for RefChem:1066543 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1066543?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1066543 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.