3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn-
TL;DR: 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn- (CAS 52904-50-4) is a chemical compound with molecular formula C19H27NO3 and molecular weight 317.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 9-methoxy-9-phenyl-3-azabicyclo[3.3.1]nonane-3-carboxylate
Also Known As: 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn-, 1-Methylethyl 9-methoxy-9-phenyl-3-azabicyclo(3.3.1)nonane-3-carboxylate syn-, propan-2-yl 9-methoxy-9-phenyl-3-azabicyclo[3.3.1]nonane-3-carboxylate, BRN 1491722, RefChem:276782
| Molecular Formula | C19H27NO3 |
|---|---|
| Molecular Weight | 317.20 g/mol |
| LogP | 3.8052 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.1991 |
| Heavy Atoms | 23 |
| Complexity | 528.80554 |
Chemical Identifiers
| CAS Number | 52904-50-4 |
|---|---|
| SMILES | CC(C)OC(=O)N1CC2CCCC(C1)C2(C3=CC=CC=C3)OC |
Product Overview
3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn- (CAS 52904-50-4), with molecular formula C19H27NO3 and molecular weight 317.20 g/mol. IUPAC: propan-2-yl 9-methoxy-9-phenyl-3-azabicyclo[3.3.1]nonane-3-carboxylate.
Chemical Property Profile of 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn-
Property Insights of 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn-
The XLogP value of 3.8052 indicates that 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn- has 0 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 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn-?
The CAS number of 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn- is 52904-50-4.
What is the molecular formula of 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn-?
The molecular formula of 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn- is C19H27NO3.
What is the molecular weight of 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn-?
The molecular weight of 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn- is 317.20 g/mol.
Where can I buy 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn-?
You can request a quote for 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn-?
Yes, KEHONG BIO provides custom synthesis services for 3-Azabicyclo(3.3.1)nonane-3-carboxylic acid, 9-methoxy-9-phenyl-, 1-methylethyl ester, syn- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.