2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)-
TL;DR: 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)- (CAS 5503-65-1) is a chemical compound with molecular formula C13H17NO2S and molecular weight 251.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonyl)-2-azabicyclo[3.2.1]octane
Also Known As: 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)-, 2-Azabicyclo[3.2.1]octane,2-(phenylsulfonyl)-, 2-(benzenesulfonyl)-2-azabicyclo[3.2.1]octane, 4-(benzenesulfonyl)-4-azabicyclo[3.2.1]octane
| Molecular Formula | C13H17NO2S |
|---|---|
| Molecular Weight | 251.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.098 |
| Heavy Atoms | 17 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 5503-65-1 |
|---|---|
| SMILES | C1CC2CC1CCN2S(=O)(=O)C3=CC=CC=C3 |
| InChIKey | GJXXYINCOHPKGH-UHFFFAOYSA-N |
Product Overview
2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)- (CAS 5503-65-1), with molecular formula C13H17NO2S and molecular weight 251.10 g/mol. IUPAC: 2-(benzenesulfonyl)-2-azabicyclo[3.2.1]octane.
Chemical Property Profile of 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)-
Property Insights of 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)-. With a topological polar surface area (TPSA) of 45.8 Ų, 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)- 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 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)-?
The CAS number of 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)- is 5503-65-1.
What is the molecular formula of 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)-?
The molecular formula of 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)- is C13H17NO2S.
What is the molecular weight of 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)-?
The molecular weight of 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)- is 251.10 g/mol.
Where can I buy 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)-?
You can request a quote for 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Azabicyclo(3.2.1)octane, 2-(phenylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.