4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine
TL;DR: 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine (CAS 1731-61-9) is a chemical compound with molecular formula C11H19NO3S and molecular weight 245.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-morpholin-4-yl-7λ6-thiabicyclo[4.2.0]octane 7,7-dioxide
Also Known As: 6-morpholin-4-yl-8, 4-(7,7-Dioxido-7-thiabicyclo[4.2.0]oct-1-yl)morpholine, NCIOpen2_007249, 2,3-Cyclohexyl-3-morpholino thietane-1,1-dioxide, BAS 00918030
| Molecular Formula | C11H19NO3S |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 55.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 245.10857 |
| Heavy Atoms | 16 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 1731-61-9 |
|---|---|
| SMILES | C1CCC2(CS(=O)(=O)C2C1)N3CCOCC3 |
| InChIKey | SDSJLPWJNCDWMK-UHFFFAOYSA-N |
Product Overview
4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine (CAS 1731-61-9), with molecular formula C11H19NO3S and molecular weight 245.11 g/mol. IUPAC: 1-morpholin-4-yl-7λ6-thiabicyclo[4.2.0]octane 7,7-dioxide.
Chemical Property Profile of 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine
Property Insights of 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine. With a topological polar surface area (TPSA) of 55.0 Ų, 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine has 0 hydrogen bond donor(s) and 4 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 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine?
The CAS number of 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine is 1731-61-9.
What is the molecular formula of 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine?
The molecular formula of 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine is C11H19NO3S.
What is the molecular weight of 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine?
The molecular weight of 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine is 245.11 g/mol.
Where can I buy 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine?
You can request a quote for 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-(7,7-Dioxido-7-thiabicyclo(4.2.0)oct-1-yl)morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.