8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one
TL;DR: 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one (CAS 374757-53-6) is a chemical compound with molecular formula C15H12O3S and molecular weight 272.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-1,3-dimethyl-6-thiophen-2-ylcyclohepta[c]furan-8-one
Also Known As: 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one, 4-hydroxy-1,3-dimethyl-6-thiophen-2-ylcyclohepta[c]furan-8-one
| Molecular Formula | C15H12O3S |
|---|---|
| Molecular Weight | 272.05 g/mol |
| LogP | 3.84394 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.05072 |
| Heavy Atoms | 19 |
| Complexity | 813.51324 |
Chemical Identifiers
| CAS Number | 374757-53-6 |
|---|---|
| SMILES | CC1=C2C(=CC(=CC(=O)C2=C(O1)C)C3=CC=CS3)O |
Product Overview
8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one (CAS 374757-53-6), with molecular formula C15H12O3S and molecular weight 272.05 g/mol. IUPAC: 4-hydroxy-1,3-dimethyl-6-thiophen-2-ylcyclohepta[c]furan-8-one.
Chemical Property Profile of 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one
Property Insights of 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one
The XLogP value of 3.84394 indicates that 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.44 Ų, 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one has 1 hydrogen bond donor(s) and 4 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 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one?
The CAS number of 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one is 374757-53-6.
What is the molecular formula of 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one?
The molecular formula of 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one is C15H12O3S.
What is the molecular weight of 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one?
The molecular weight of 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one is 272.05 g/mol.
Where can I buy 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one?
You can request a quote for 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one?
Yes, KEHONG BIO provides custom synthesis services for 8-hydroxy-1,3-dimethyl-6-(thiophen-2-yl)-4H-cyclohepta[c]furan-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.