4H-1-Benzopyran-4-one, 3,3'-dithiobis-
TL;DR: 4H-1-Benzopyran-4-one, 3,3'-dithiobis- (CAS 88883-89-0) is a chemical compound with molecular formula C18H10O4S2 and molecular weight 354.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-oxochromen-3-yl)disulfanyl]chromen-4-one
Also Known As: 4H-1-Benzopyran-4-one, 3,3'-dithiobis-, 3,3'-Dithiobis-4H-1-benzopyran-4-one, 3-[(4-oxochromen-3-yl)disulfanyl]chromen-4-one, 3-(4-oxochromen-3-yl)disulfanylchromen-4-one, 3,3'-Disulfanediyldi(4H-1-benzopyran-4-one)
| Molecular Formula | C18H10O4S2 |
|---|---|
| Molecular Weight | 354.00 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.00204 |
| Heavy Atoms | 24 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 88883-89-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=CO2)SSC3=COC4=CC=CC=C4C3=O |
| InChIKey | MULZBSUWIURFBE-UHFFFAOYSA-N |
Product Overview
4H-1-Benzopyran-4-one, 3,3'-dithiobis- (CAS 88883-89-0), with molecular formula C18H10O4S2 and molecular weight 354.00 g/mol. IUPAC: 3-[(4-oxochromen-3-yl)disulfanyl]chromen-4-one.
Chemical Property Profile of 4H-1-Benzopyran-4-one, 3,3'-dithiobis-
Property Insights of 4H-1-Benzopyran-4-one, 3,3'-dithiobis-
The XLogP value of 3.7 indicates that 4H-1-Benzopyran-4-one, 3,3'-dithiobis- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-1-Benzopyran-4-one, 3,3'-dithiobis-. Following Lipinski's Rule of Five, 4H-1-Benzopyran-4-one, 3,3'-dithiobis- has 0 hydrogen bond donor(s) and 6 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 4H-1-Benzopyran-4-one, 3,3'-dithiobis-?
The CAS number of 4H-1-Benzopyran-4-one, 3,3'-dithiobis- is 88883-89-0.
What is the molecular formula of 4H-1-Benzopyran-4-one, 3,3'-dithiobis-?
The molecular formula of 4H-1-Benzopyran-4-one, 3,3'-dithiobis- is C18H10O4S2.
What is the molecular weight of 4H-1-Benzopyran-4-one, 3,3'-dithiobis-?
The molecular weight of 4H-1-Benzopyran-4-one, 3,3'-dithiobis- is 354.00 g/mol.
Where can I buy 4H-1-Benzopyran-4-one, 3,3'-dithiobis-?
You can request a quote for 4H-1-Benzopyran-4-one, 3,3'-dithiobis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-1-Benzopyran-4-one, 3,3'-dithiobis-?
Yes, KEHONG BIO provides custom synthesis services for 4H-1-Benzopyran-4-one, 3,3'-dithiobis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.