![3,3-Dimethylbenzo[f]thiochromene structure](/static/products/173/173469-08-4.png)
3,3-Dimethylbenzo[f]thiochromene
TL;DR: 3,3-Dimethylbenzo[f]thiochromene (CAS 173469-08-4) is a chemical compound with molecular formula C15H14S and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethylbenzo[f]thiochromene
Also Known As: 3,3-dimethylbenzo[f]thiochromene, 3,3-dimethyl-3H-benzo[f]thiochromene
| Molecular Formula | C15H14S |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 4.7373 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.08162 |
| Heavy Atoms | 16 |
| Complexity | 579.0047 |
Chemical Identifiers
| CAS Number | 173469-08-4 |
|---|---|
| SMILES | CC1(C=CC2=C(S1)C=CC3=CC=CC=C32)C |
Product Overview
3,3-Dimethylbenzo[f]thiochromene (CAS 173469-08-4), with molecular formula C15H14S and molecular weight 226.08 g/mol. IUPAC: 3,3-dimethylbenzo[f]thiochromene.
Chemical Property Profile of 3,3-Dimethylbenzo[f]thiochromene
Property Insights of 3,3-Dimethylbenzo[f]thiochromene
The XLogP value of 4.7373 indicates that 3,3-Dimethylbenzo[f]thiochromene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,3-Dimethylbenzo[f]thiochromene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethylbenzo[f]thiochromene has 0 hydrogen bond donor(s) and 1 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 3,3-Dimethylbenzo[f]thiochromene?
The CAS number of 3,3-Dimethylbenzo[f]thiochromene is 173469-08-4.
What is the molecular formula of 3,3-Dimethylbenzo[f]thiochromene?
The molecular formula of 3,3-Dimethylbenzo[f]thiochromene is C15H14S.
What is the molecular weight of 3,3-Dimethylbenzo[f]thiochromene?
The molecular weight of 3,3-Dimethylbenzo[f]thiochromene is 226.08 g/mol.
Where can I buy 3,3-Dimethylbenzo[f]thiochromene?
You can request a quote for 3,3-Dimethylbenzo[f]thiochromene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethylbenzo[f]thiochromene?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethylbenzo[f]thiochromene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.