5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione
TL;DR: 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione (CAS 4858-33-7) is a chemical compound with molecular formula C18H34N2S3 and molecular weight 374.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hexadecylsulfanyl-3H-1,3,4-thiadiazole-2-thione
Also Known As: starbld0040615, 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione, 5-hexadecylsulfanyl-3H-1,3,4-thiadiazole-2-thione, 5-(Hexadecylthio)-1,3,4-thiadiazole-2(3H)-thione, 5-Hexadecylthio-1,3,4-thiadiazole-2(3H)-thione
| Molecular Formula | C18H34N2S3 |
|---|---|
| Molecular Weight | 374.19 g/mol |
| LogP | 7.77409 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 374.18842 |
| Heavy Atoms | 23 |
| Complexity | 414.39923 |
Chemical Identifiers
| CAS Number | 4858-33-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCSC1=NNC(=S)S1 |
Product Overview
5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione (CAS 4858-33-7), with molecular formula C18H34N2S3 and molecular weight 374.19 g/mol. IUPAC: 5-hexadecylsulfanyl-3H-1,3,4-thiadiazole-2-thione.
Chemical Property Profile of 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione
Property Insights of 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione
The XLogP value of 7.77409 indicates that 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.68 Ų, 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione 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 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione?
The CAS number of 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione is 4858-33-7.
What is the molecular formula of 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione?
The molecular formula of 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione is C18H34N2S3.
What is the molecular weight of 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione?
The molecular weight of 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione is 374.19 g/mol.
Where can I buy 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione?
You can request a quote for 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-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-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-(Hexadecylsulfanyl)-2,3-dihydro-1,3,4-thiadiazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.