5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione
TL;DR: 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione (CAS 304013-23-8) is a chemical compound with molecular formula C21H30OS2Se and molecular weight 442.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-dodecoxyphenyl)-1,3-thiaselenole-2-thione
Also Known As: BAS 00094070, 5-(4-dodecoxyphenyl)-1,3-thiaselenole-2-thione, 5-(4-dodecyloxyphenyl)-1,3-thiaselenolene-2-thione, 5-(4-(dodecyloxy)phenyl)-1,3-thiaselenole-2-thione, 5-(4-Dodecyloxy-phenyl)-[1,3]thiaselenole-2-thione
| Molecular Formula | C21H30OS2Se |
|---|---|
| Molecular Weight | 442.09 g/mol |
| LogP | 7.50129 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 442.09033 |
| Heavy Atoms | 25 |
| Complexity | 629.84564 |
Chemical Identifiers
| CAS Number | 304013-23-8 |
|---|---|
| SMILES | CCCCCCCCCCCCOC1=CC=C(C=C1)C2=C[Se]C(=S)S2 |
Product Overview
5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione (CAS 304013-23-8), with molecular formula C21H30OS2Se and molecular weight 442.09 g/mol. IUPAC: 5-(4-dodecoxyphenyl)-1,3-thiaselenole-2-thione.
Chemical Property Profile of 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione
Property Insights of 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione
The XLogP value of 7.50129 indicates that 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione?
The CAS number of 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione is 304013-23-8.
What is the molecular formula of 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione?
The molecular formula of 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione is C21H30OS2Se.
What is the molecular weight of 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione?
The molecular weight of 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione is 442.09 g/mol.
Where can I buy 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione?
You can request a quote for 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-(Dodecyloxy)phenyl)-1,3-thiaselenole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.