3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine
TL;DR: 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine (CAS 864818-68-8) is a chemical compound with molecular formula C26H45NO3 and molecular weight 419.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]-6-methylheptan-1-amine
Also Known As: 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine, 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]-6-methylheptan-1-amine, 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-N-(4-isopropoxy-3-methoxybenzyl)-6-methylheptan-1-amine, 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-N-[3-methoxy-4-(propan-2-yloxy)benzyl]-6-methylheptan-1-amine
| Molecular Formula | C26H45NO3 |
|---|---|
| Molecular Weight | 419.34 g/mol |
| LogP | 6.2197 |
| Topological Polar Surface Area | 39.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 419.33994 |
| Heavy Atoms | 30 |
| Complexity | 626.7048 |
Chemical Identifiers
| CAS Number | 864818-68-8 |
|---|---|
| SMILES | CC(C)CCC(CCNCC1=CC(=C(C=C1)OC(C)C)OC)C2CCOC(C2)(C)C |
Product Overview
3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine (CAS 864818-68-8), with molecular formula C26H45NO3 and molecular weight 419.34 g/mol. IUPAC: 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]-6-methylheptan-1-amine.
Chemical Property Profile of 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine
Property Insights of 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine
The XLogP value of 6.2197 indicates that 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.72 Ų, 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine?
The CAS number of 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine is 864818-68-8.
What is the molecular formula of 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine?
The molecular formula of 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine is C26H45NO3.
What is the molecular weight of 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine?
The molecular weight of 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine is 419.34 g/mol.
Where can I buy 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine?
You can request a quote for 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,2-dimethyloxan-4-yl)-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]-6-methyl-heptan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.