cis-2,6-Diphenyl-4-tetrahydrothiopyranone
TL;DR: cis-2,6-Diphenyl-4-tetrahydrothiopyranone (CAS 18456-44-5) is a chemical compound with molecular formula C17H16OS and molecular weight 268.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,6R)-2,6-diphenylthian-4-one
Also Known As: 2,6-diphenyl-thiopyran-4-one, (2R,6S)-2,6-diphenylthian-4-one, (2S,6R)-2,6-diphenylthian-4-one, cis-2,6-Diphenyl-4-tetrahydrothiopyranone, cis-2,6-diphenyltetrahydrothiopyran-4-one
| Molecular Formula | C17H16OS |
|---|---|
| Molecular Weight | 268.09 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.0922 |
| Heavy Atoms | 19 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 18456-44-5 |
|---|---|
| SMILES | C1[C@@H](S[C@@H](CC1=O)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | PPJHHCQGZVIWAR-CALCHBBNSA-N |
Product Overview
cis-2,6-Diphenyl-4-tetrahydrothiopyranone (CAS 18456-44-5), with molecular formula C17H16OS and molecular weight 268.09 g/mol. IUPAC: (2S,6R)-2,6-diphenylthian-4-one.
Chemical Property Profile of cis-2,6-Diphenyl-4-tetrahydrothiopyranone
Property Insights of cis-2,6-Diphenyl-4-tetrahydrothiopyranone
The XLogP value of 3.4 indicates that cis-2,6-Diphenyl-4-tetrahydrothiopyranone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, cis-2,6-Diphenyl-4-tetrahydrothiopyranone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-2,6-Diphenyl-4-tetrahydrothiopyranone 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 cis-2,6-Diphenyl-4-tetrahydrothiopyranone?
The CAS number of cis-2,6-Diphenyl-4-tetrahydrothiopyranone is 18456-44-5.
What is the molecular formula of cis-2,6-Diphenyl-4-tetrahydrothiopyranone?
The molecular formula of cis-2,6-Diphenyl-4-tetrahydrothiopyranone is C17H16OS.
What is the molecular weight of cis-2,6-Diphenyl-4-tetrahydrothiopyranone?
The molecular weight of cis-2,6-Diphenyl-4-tetrahydrothiopyranone is 268.09 g/mol.
Where can I buy cis-2,6-Diphenyl-4-tetrahydrothiopyranone?
You can request a quote for cis-2,6-Diphenyl-4-tetrahydrothiopyranone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-2,6-Diphenyl-4-tetrahydrothiopyranone?
Yes, KEHONG BIO provides custom synthesis services for cis-2,6-Diphenyl-4-tetrahydrothiopyranone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.