4-Phenylthio-1,8-naphthalic anhydride
TL;DR: 4-Phenylthio-1,8-naphthalic anhydride (CAS 54470-29-0) is a chemical compound with molecular formula C18H10O3S and molecular weight 306.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-phenylsulfanyl-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-2,4-dione
Also Known As: 4-PHENYLTHIO-1,8-NAPHTHALIC ANHYDRIDE, 6-(Phenylthio)benzo[de]isochromene-1,3-dione, 6-(phenylsulfanyl)-1H,3H-benzo[de]isochromene-1,3-dione, 1H,3H-Naphtho[1,8-cd]pyran-1,3-dione, 6-(phenylthio)-, 665-745-1
| Molecular Formula | C18H10O3S |
|---|---|
| Molecular Weight | 306.04 g/mol |
| LogP | 4.3016 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.03506 |
| Heavy Atoms | 22 |
| Complexity | 896.0185 |
Chemical Identifiers
| CAS Number | 54470-29-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=C3C=CC=C4C3=C(C=C2)C(=O)OC4=O |
Product Overview
4-Phenylthio-1,8-naphthalic anhydride (CAS 54470-29-0), with molecular formula C18H10O3S and molecular weight 306.04 g/mol. IUPAC: 8-phenylsulfanyl-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-2,4-dione.
Chemical Property Profile of 4-Phenylthio-1,8-naphthalic anhydride
Property Insights of 4-Phenylthio-1,8-naphthalic anhydride
The XLogP value of 4.3016 indicates that 4-Phenylthio-1,8-naphthalic anhydride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 4-Phenylthio-1,8-naphthalic anhydride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Phenylthio-1,8-naphthalic anhydride has 0 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 4-Phenylthio-1,8-naphthalic anhydride?
The CAS number of 4-Phenylthio-1,8-naphthalic anhydride is 54470-29-0.
What is the molecular formula of 4-Phenylthio-1,8-naphthalic anhydride?
The molecular formula of 4-Phenylthio-1,8-naphthalic anhydride is C18H10O3S.
What is the molecular weight of 4-Phenylthio-1,8-naphthalic anhydride?
The molecular weight of 4-Phenylthio-1,8-naphthalic anhydride is 306.04 g/mol.
Where can I buy 4-Phenylthio-1,8-naphthalic anhydride?
You can request a quote for 4-Phenylthio-1,8-naphthalic anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phenylthio-1,8-naphthalic anhydride?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenylthio-1,8-naphthalic anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.