2-Methyl-4h-chromene-4-thione
TL;DR: 2-Methyl-4h-chromene-4-thione (CAS 51138-52-4) is a chemical compound with molecular formula C10H8OS and molecular weight 176.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylchromene-4-thione
Also Known As: methylthiochromone, 2-methylchromene-4-thione, 2-methyl-4h-chromene-4-thione, 2-methylchromone-4-thione, 2-Methyl-4H-1-benzopyran-4-thione
| Molecular Formula | C10H8OS |
|---|---|
| Molecular Weight | 176.03 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 41.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 176.02959 |
| Heavy Atoms | 12 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 51138-52-4 |
|---|---|
| SMILES | CC1=CC(=S)C2=CC=CC=C2O1 |
| InChIKey | PQJVKDVVNUPEPT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-4h-chromene-4-thione (CAS 51138-52-4), with molecular formula C10H8OS and molecular weight 176.03 g/mol. IUPAC: 2-methylchromene-4-thione.
Chemical Property Profile of 2-Methyl-4h-chromene-4-thione
Property Insights of 2-Methyl-4h-chromene-4-thione
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-4h-chromene-4-thione. With a topological polar surface area (TPSA) of 41.3 Ų, 2-Methyl-4h-chromene-4-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-4h-chromene-4-thione 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 2-Methyl-4h-chromene-4-thione?
The CAS number of 2-Methyl-4h-chromene-4-thione is 51138-52-4.
What is the molecular formula of 2-Methyl-4h-chromene-4-thione?
The molecular formula of 2-Methyl-4h-chromene-4-thione is C10H8OS.
What is the molecular weight of 2-Methyl-4h-chromene-4-thione?
The molecular weight of 2-Methyl-4h-chromene-4-thione is 176.03 g/mol.
Where can I buy 2-Methyl-4h-chromene-4-thione?
You can request a quote for 2-Methyl-4h-chromene-4-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-4h-chromene-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4h-chromene-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.