1-乙基吩噁噻吩10,10-二氧化物
TL;DR: 1-乙基吩噁噻吩10,10-二氧化物 (CAS 134476-36-1) is a chemical compound with molecular formula C14H12O3S and molecular weight 260.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-乙基吩噁噻吩10,10-二氧化物
1-ethylphenoxathiine 10,10-dioxide
Also Known As: 1-Ethylphenoxathiin 10,10-dioxide, 1-ethylphenoxathiine 10,10-dioxide, Phenoxathiin, 1-ethyl-,10,10-dioxide, Phenoxathiin, 1-ethyl-, 10,10-dioxide, 1-Ethylphenoxathiin-10,10-dioxide
| Molecular Formula | C14H12O3S |
|---|---|
| Molecular Weight | 260.05 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 260.05072 |
| Heavy Atoms | 18 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 134476-36-1 |
|---|---|
| SMILES | CCC1=C2C(=CC=C1)OC3=CC=CC=C3S2(=O)=O |
| InChIKey | HQSRQKBSOOZLHH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-乙基吩噁噻吩10,10-二氧化物 (CAS 134476-36-1), with molecular formula C14H12O3S and molecular weight 260.05 g/mol. IUPAC: 1-ethylphenoxathiine 10,10-dioxide.
Chemical Property Profile of 1-乙基吩噁噻吩10,10-二氧化物
Property Insights of 1-乙基吩噁噻吩10,10-二氧化物
The XLogP value of 3.1 indicates that 1-乙基吩噁噻吩10,10-二氧化物 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 1-乙基吩噁噻吩10,10-二氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-乙基吩噁噻吩10,10-二氧化物 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 1-乙基吩噁噻吩10,10-二氧化物?
The CAS number of 1-乙基吩噁噻吩10,10-二氧化物 is 134476-36-1.
What is the molecular formula of 1-乙基吩噁噻吩10,10-二氧化物?
The molecular formula of 1-乙基吩噁噻吩10,10-二氧化物 is C14H12O3S.
What is the molecular weight of 1-乙基吩噁噻吩10,10-二氧化物?
The molecular weight of 1-乙基吩噁噻吩10,10-二氧化物 is 260.05 g/mol.
Where can I buy 1-乙基吩噁噻吩10,10-二氧化物?
You can request a quote for 1-乙基吩噁噻吩10,10-二氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-乙基吩噁噻吩10,10-二氧化物?
Yes, KEHONG BIO provides custom synthesis services for 1-乙基吩噁噻吩10,10-二氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.