![5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine structure](/static/products/391/39181-54-9.png)
5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine
TL;DR: 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine (CAS 39181-54-9) is a chemical compound with molecular formula C9H8FN3S and molecular weight 209.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine
Also Known As: 5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine, 5-(3-Fluorobenzyl)-1,3,4-thiadiazol-2-amine, ASN 01917127, 2-Amino-5-(3-fluorobenzyl)-1,3,4-thiadiazole, 5-(3-Fluoro-benzyl)-[1,3,4]thiadiazol-2-ylamine
| Molecular Formula | C9H8FN3S |
|---|---|
| Molecular Weight | 209.04 g/mol |
| LogP | 1.8502 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.0423 |
| Heavy Atoms | 14 |
| Complexity | 441.12704 |
Chemical Identifiers
| CAS Number | 39181-54-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)CC2=NN=C(S2)N |
Product Overview
5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine (CAS 39181-54-9), with molecular formula C9H8FN3S and molecular weight 209.04 g/mol. IUPAC: 5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine.
Chemical Property Profile of 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine
Property Insights of 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine
The XLogP value of 1.8502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine. With a topological polar surface area (TPSA) of 51.8 Ų, 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine has 1 hydrogen bond donor(s) and 4 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-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine?
The CAS number of 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine is 39181-54-9.
What is the molecular formula of 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine?
The molecular formula of 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine is C9H8FN3S.
What is the molecular weight of 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine?
The molecular weight of 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine is 209.04 g/mol.
Where can I buy 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine?
You can request a quote for 5-[(3-Fluorophenyl)methyl]-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-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 5-[(3-Fluorophenyl)methyl]-1,3,4-thiadiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.