2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione
TL;DR: 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione (CAS 585556-34-9) is a chemical compound with molecular formula C25H22O2S and molecular weight 386.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,6-diphenylthiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione
Also Known As: 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione, 2-(4,6-diphenylthiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione
| Molecular Formula | C25H22O2S |
|---|---|
| Molecular Weight | 386.13 g/mol |
| LogP | 6.0702 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 386.13406 |
| Heavy Atoms | 28 |
| Complexity | 1002.73224 |
Chemical Identifiers
| CAS Number | 585556-34-9 |
|---|---|
| SMILES | CC1(CC(=O)C(=C2C=C(C=C(S2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C1)C |
Product Overview
2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione (CAS 585556-34-9), with molecular formula C25H22O2S and molecular weight 386.13 g/mol. IUPAC: 2-(4,6-diphenylthiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione.
Chemical Property Profile of 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione
Property Insights of 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione
The XLogP value of 6.0702 indicates that 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione?
The CAS number of 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione is 585556-34-9.
What is the molecular formula of 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione?
The molecular formula of 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione is C25H22O2S.
What is the molecular weight of 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione?
The molecular weight of 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione is 386.13 g/mol.
Where can I buy 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione?
You can request a quote for 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4,6-diphenyl-2H-thiopyran-2-ylidene)-5,5-dimethylcyclohexane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.