5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine
TL;DR: 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine (CAS 110076-51-2) is a chemical compound with molecular formula C10H11N3OS2 and molecular weight 253.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine
Also Known As: 5-{[(3-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine, 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine, 5-[(3-methoxybenzyl)sulfanyl]-1,3,4-thiadiazol-2-ylamine, 5-[(3-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine, J1.524.515H
| Molecular Formula | C10H11N3OS2 |
|---|---|
| Molecular Weight | 253.03 g/mol |
| LogP | 2.4212 |
| Topological Polar Surface Area | 61.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.03435 |
| Heavy Atoms | 16 |
| Complexity | 472.59262 |
Chemical Identifiers
| CAS Number | 110076-51-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CSC2=NN=C(S2)N |
Product Overview
5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine (CAS 110076-51-2), with molecular formula C10H11N3OS2 and molecular weight 253.03 g/mol. IUPAC: 5-[(3-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine.
Chemical Property Profile of 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine
Property Insights of 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine
The XLogP value of 2.4212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine. The TPSA of 61.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine. Following Lipinski's Rule of Five, 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine has 1 hydrogen bond donor(s) and 6 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 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine?
The CAS number of 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine is 110076-51-2.
What is the molecular formula of 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine?
The molecular formula of 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine is C10H11N3OS2.
What is the molecular weight of 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine?
The molecular weight of 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine is 253.03 g/mol.
Where can I buy 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine?
You can request a quote for 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 5-((3-Methoxybenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.