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Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate
TL;DR: Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate (CAS 438480-38-7) is a chemical compound with molecular formula C17H27NO3 and molecular weight 293.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate
Also Known As: methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate, VU0178959-4, methyl N-[(3,5,7-trimethyl-1-adamantyl)carbonyl]glycinate, methyl 2-[(3,5,7-trimethyl-1-adamantyl)carbonylamino]ethanoate, 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetic acid methyl ester
| Molecular Formula | C17H27NO3 |
|---|---|
| Molecular Weight | 293.20 g/mol |
| LogP | 2.6623 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.1991 |
| Heavy Atoms | 21 |
| Complexity | 444.7148 |
Chemical Identifiers
| CAS Number | 438480-38-7 |
|---|---|
| SMILES | CC12CC3(CC(C1)(CC(C2)(C3)C(=O)NCC(=O)OC)C)C |
Product Overview
Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate (CAS 438480-38-7), with molecular formula C17H27NO3 and molecular weight 293.20 g/mol. IUPAC: methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate.
Chemical Property Profile of Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate
Property Insights of Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate
The XLogP value of 2.6623 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate has 1 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 Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate?
The CAS number of Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate is 438480-38-7.
What is the molecular formula of Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate?
The molecular formula of Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate is C17H27NO3.
What is the molecular weight of Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate?
The molecular weight of Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate is 293.20 g/mol.
Where can I buy Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate?
You can request a quote for Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(3,5,7-trimethyladamantane-1-carbonyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.