2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione
TL;DR: 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione (CAS 67304-43-2) is a chemical compound with molecular formula C26H39NO2S and molecular weight 429.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-hexadecylsulfanylnaphthalene-1,4-dione
Also Known As: 2-amino-3-hexadecylsulfanylnaphthalene-1,4-dione, J1.513.303A, 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione, 2-Amino-3-(hexadecylthio)-1,4-naphthoquinone, 2-amino-3-(hexadecylsulfanyl)-1,4-dihydronaphthalene-1,4-dione
| Molecular Formula | C26H39NO2S |
|---|---|
| Molecular Weight | 429.27 g/mol |
| LogP | 9.4 |
| Topological Polar Surface Area | 85.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 429.27014 |
| Heavy Atoms | 30 |
| Complexity | 557.0 |
Chemical Identifiers
| CAS Number | 67304-43-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCSC1=C(C(=O)C2=CC=CC=C2C1=O)N |
| InChIKey | FUTDGFVPFKIEOA-UHFFFAOYSA-N |
Product Overview
2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione (CAS 67304-43-2), with molecular formula C26H39NO2S and molecular weight 429.27 g/mol. IUPAC: 2-amino-3-hexadecylsulfanylnaphthalene-1,4-dione.
Chemical Property Profile of 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione
Property Insights of 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione
The XLogP value of 9.4 indicates that 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione. Following Lipinski's Rule of Five, 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione?
The CAS number of 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione is 67304-43-2.
What is the molecular formula of 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione?
The molecular formula of 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione is C26H39NO2S.
What is the molecular weight of 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione?
The molecular weight of 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione is 429.27 g/mol.
Where can I buy 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione?
You can request a quote for 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-3-(hexadecylsulfanyl)naphthalene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.