s-Triazole, 3-propyl-
TL;DR: s-Triazole, 3-propyl- (CAS 19932-60-6) is a chemical compound with molecular formula C5H9N3 and molecular weight 111.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-propyl-1H-1,2,4-triazole
Also Known As: s-Triazole, 3-propyl-, 3-Propyl-1H-1,2,4-triazole, 5-propyl-1H-1,2,4-triazole, 1H-1,2,4-Triazole, 3-propyl-, 1H-1,2,4-Triazole, 5-propyl-
| Molecular Formula | C5H9N3 |
|---|---|
| Molecular Weight | 111.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 111.07965 |
| Heavy Atoms | 8 |
| Complexity | 64.0 |
Chemical Identifiers
| CAS Number | 19932-60-6 |
|---|---|
| SMILES | CCCC1=NC=NN1 |
| InChIKey | ZFWJVKLPEZPKNL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
s-Triazole, 3-propyl- (CAS 19932-60-6), with molecular formula C5H9N3 and molecular weight 111.08 g/mol. IUPAC: 5-propyl-1H-1,2,4-triazole.
Chemical Property Profile of s-Triazole, 3-propyl-
Property Insights of s-Triazole, 3-propyl-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for s-Triazole, 3-propyl-. With a topological polar surface area (TPSA) of 41.6 Ų, s-Triazole, 3-propyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, s-Triazole, 3-propyl- has 1 hydrogen bond donor(s) and 2 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 s-Triazole, 3-propyl-?
The CAS number of s-Triazole, 3-propyl- is 19932-60-6.
What is the molecular formula of s-Triazole, 3-propyl-?
The molecular formula of s-Triazole, 3-propyl- is C5H9N3.
What is the molecular weight of s-Triazole, 3-propyl-?
The molecular weight of s-Triazole, 3-propyl- is 111.08 g/mol.
Where can I buy s-Triazole, 3-propyl-?
You can request a quote for s-Triazole, 3-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for s-Triazole, 3-propyl-?
Yes, KEHONG BIO provides custom synthesis services for s-Triazole, 3-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.