Thiirene, diphenyl-, 1-oxide
TL;DR: Thiirene, diphenyl-, 1-oxide (CAS 5162-99-2) is a chemical compound with molecular formula C14H10OS and molecular weight 226.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-diphenylthiirene 1-oxide
Also Known As: Thiirene, diphenyl-, 1-oxide, 2,3-Diphenylthiirene 1-oxide, Thiirene,diphenyl-1-oxide, 2, 3-Diphenylthiirene 1-oxide, 2,3-Diphenyl-thiirene 1-oxide
| Molecular Formula | C14H10OS |
|---|---|
| Molecular Weight | 226.05 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.04524 |
| Heavy Atoms | 16 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 5162-99-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(S2=O)C3=CC=CC=C3 |
| InChIKey | QHVCBIAMWFIPHT-UHFFFAOYSA-N |
Product Overview
Thiirene, diphenyl-, 1-oxide (CAS 5162-99-2), with molecular formula C14H10OS and molecular weight 226.05 g/mol. IUPAC: 2,3-diphenylthiirene 1-oxide.
Chemical Property Profile of Thiirene, diphenyl-, 1-oxide
Property Insights of Thiirene, diphenyl-, 1-oxide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiirene, diphenyl-, 1-oxide. With a topological polar surface area (TPSA) of 45.3 Ų, Thiirene, diphenyl-, 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiirene, diphenyl-, 1-oxide has 0 hydrogen bond donor(s) and 2 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 Thiirene, diphenyl-, 1-oxide?
The CAS number of Thiirene, diphenyl-, 1-oxide is 5162-99-2.
What is the molecular formula of Thiirene, diphenyl-, 1-oxide?
The molecular formula of Thiirene, diphenyl-, 1-oxide is C14H10OS.
What is the molecular weight of Thiirene, diphenyl-, 1-oxide?
The molecular weight of Thiirene, diphenyl-, 1-oxide is 226.05 g/mol.
Where can I buy Thiirene, diphenyl-, 1-oxide?
You can request a quote for Thiirene, diphenyl-, 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiirene, diphenyl-, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for Thiirene, diphenyl-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.