1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride
TL;DR: 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride (CAS 69766-49-0) is a chemical compound with molecular formula C21H24ClNO2 and molecular weight 357.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azoniabicyclo[3.2.1]octan-6-yl 2,2-diphenylacetate chloride
Also Known As: Ro 2-3244, 6-Diphenylacetoxy-1-azabicyclo(3.2.1)octane hydrochloride, 1-AZABICYCLO(3.2.1)OCTAN-6-OL DIPHENYLACETATE HYDROCHLORIDE, 1-azoniabicyclo[3.2.1]octan-6-yl 2,2-diphenylacetate chloride, RefChem:227634
| Molecular Formula | C21H24ClNO2 |
|---|---|
| Molecular Weight | 357.15 g/mol |
| LogP | -0.96 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 357.14957 |
| Heavy Atoms | 25 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 69766-49-0 |
|---|---|
| SMILES | C1CC2C[NH+](C1)CC2OC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-] |
| InChIKey | OBCBYPHOXFOJBP-UHFFFAOYSA-N |
Product Overview
1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride (CAS 69766-49-0), with molecular formula C21H24ClNO2 and molecular weight 357.15 g/mol. IUPAC: 1-azoniabicyclo[3.2.1]octan-6-yl 2,2-diphenylacetate chloride.
Chemical Property Profile of 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride
Property Insights of 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride
The XLogP value of -0.96 indicates that 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.7 Ų, 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride 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 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride?
The CAS number of 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride is 69766-49-0.
What is the molecular formula of 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride?
The molecular formula of 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride is C21H24ClNO2.
What is the molecular weight of 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride?
The molecular weight of 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride is 357.15 g/mol.
Where can I buy 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride?
You can request a quote for 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Azabicyclo(3.2.1)octan-6-ol diphenylacetate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.