3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate
TL;DR: 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate (CAS 753467-39-9) is a chemical compound with molecular formula C21H27NO4 and molecular weight 357.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methoxyphenyl)methyl 3-acetamidoadamantane-1-carboxylate
Also Known As: 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate, (3-methoxyphenyl)methyl 3-acetamidoadamantane-1-carboxylate
| Molecular Formula | C21H27NO4 |
|---|---|
| Molecular Weight | 357.19 g/mol |
| LogP | 3.2135 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 357.194 |
| Heavy Atoms | 26 |
| Complexity | 714.4762 |
Chemical Identifiers
| CAS Number | 753467-39-9 |
|---|---|
| SMILES | CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC4=CC(=CC=C4)OC |
Product Overview
3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate (CAS 753467-39-9), with molecular formula C21H27NO4 and molecular weight 357.19 g/mol. IUPAC: (3-methoxyphenyl)methyl 3-acetamidoadamantane-1-carboxylate.
Chemical Property Profile of 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate
Property Insights of 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate
The XLogP value of 3.2135 indicates that 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate. Following Lipinski's Rule of Five, 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate 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
Frequently Asked Questions
What is the CAS number of 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate?
The CAS number of 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate is 753467-39-9.
What is the molecular formula of 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate?
The molecular formula of 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate is C21H27NO4.
What is the molecular weight of 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate?
The molecular weight of 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate is 357.19 g/mol.
Where can I buy 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate?
You can request a quote for 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxybenzyl 3-acetamidoadamantane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.