7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol
TL;DR: 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol (CAS 89398-08-3) is a chemical compound with molecular formula C20H23NOS and molecular weight 325.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-9-phenyl-3-thia-7-azabicyclo[3.3.1]nonan-9-ol
Also Known As: 7-Bptan, 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol, 7-benzyl-9-phenyl-3-thia-7-azabicyclo[3.3.1]nonan-9-ol, 3-Thia-7-azabicyclo[3.3.1]nonan-9-ol,9-phenyl-7-(phenylmethyl)-, syn- (9CI), RefChem:105845
| Molecular Formula | C20H23NOS |
|---|---|
| Molecular Weight | 325.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 48.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.15002 |
| Heavy Atoms | 23 |
| Complexity | 375.0 |
Chemical Identifiers
| CAS Number | 89398-08-3 |
|---|---|
| SMILES | C1C2CSCC(C2(C3=CC=CC=C3)O)CN1CC4=CC=CC=C4 |
| InChIKey | YQDDHWHBYAKZDJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol (CAS 89398-08-3), with molecular formula C20H23NOS and molecular weight 325.15 g/mol. IUPAC: 7-benzyl-9-phenyl-3-thia-7-azabicyclo[3.3.1]nonan-9-ol.
Chemical Property Profile of 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol
Property Insights of 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol
The XLogP value of 3.1 indicates that 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.8 Ų, 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol 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 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol?
The CAS number of 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol is 89398-08-3.
What is the molecular formula of 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol?
The molecular formula of 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol is C20H23NOS.
What is the molecular weight of 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol?
The molecular weight of 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol is 325.15 g/mol.
Where can I buy 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol?
You can request a quote for 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol?
Yes, KEHONG BIO provides custom synthesis services for 7-Benzyl-9-phenyl-3-thia-7-azabicyclo(3.3.1)nonan-9-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.