1,3,4-Thiadiazol-2-amine, 5-(octylthio)-
TL;DR: 1,3,4-Thiadiazol-2-amine, 5-(octylthio)- (CAS 40177-31-9) is a chemical compound with molecular formula C10H19N3S2 and molecular weight 245.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-octylsulfanyl-1,3,4-thiadiazol-2-amine
Also Known As: 5-octylsulfanyl-1,3,4-thiadiazol-2-amine, 1,3,4-Thiadiazol-2-amine, 5-(octylthio)-, 5-(octylthio)-1,3,4-thiadiazol-2-amine, 5-(OCTYLSULFANYL)-1,3,4-THIADIAZOL-2-AMINE, RefChem:217016
| Molecular Formula | C10H19N3S2 |
|---|---|
| Molecular Weight | 245.10 g/mol |
| LogP | 3.5729 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 245.10204 |
| Heavy Atoms | 15 |
| Complexity | 262.9251 |
Chemical Identifiers
| CAS Number | 40177-31-9 |
|---|---|
| SMILES | CCCCCCCCSC1=NN=C(S1)N |
Product Overview
1,3,4-Thiadiazol-2-amine, 5-(octylthio)- (CAS 40177-31-9), with molecular formula C10H19N3S2 and molecular weight 245.10 g/mol. IUPAC: 5-octylsulfanyl-1,3,4-thiadiazol-2-amine.
Chemical Property Profile of 1,3,4-Thiadiazol-2-amine, 5-(octylthio)-
Property Insights of 1,3,4-Thiadiazol-2-amine, 5-(octylthio)-
The XLogP value of 3.5729 indicates that 1,3,4-Thiadiazol-2-amine, 5-(octylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 1,3,4-Thiadiazol-2-amine, 5-(octylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4-Thiadiazol-2-amine, 5-(octylthio)- has 1 hydrogen bond donor(s) and 5 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 1,3,4-Thiadiazol-2-amine, 5-(octylthio)-?
The CAS number of 1,3,4-Thiadiazol-2-amine, 5-(octylthio)- is 40177-31-9.
What is the molecular formula of 1,3,4-Thiadiazol-2-amine, 5-(octylthio)-?
The molecular formula of 1,3,4-Thiadiazol-2-amine, 5-(octylthio)- is C10H19N3S2.
What is the molecular weight of 1,3,4-Thiadiazol-2-amine, 5-(octylthio)-?
The molecular weight of 1,3,4-Thiadiazol-2-amine, 5-(octylthio)- is 245.10 g/mol.
Where can I buy 1,3,4-Thiadiazol-2-amine, 5-(octylthio)-?
You can request a quote for 1,3,4-Thiadiazol-2-amine, 5-(octylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Thiadiazol-2-amine, 5-(octylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Thiadiazol-2-amine, 5-(octylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.