2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol
TL;DR: 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol (CAS 120029-40-5) is a chemical compound with molecular formula C17H17N3O and molecular weight 279.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-phenyl-5-propyl-1,2,4-triazol-3-yl)phenol
Also Known As: 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol, AE-848/30690003, 2-(2-PHENYL-5-PROPYL-1,2,4-TRIAZOL-3-YL)PHENOL, (6E)-6-(2-phenyl-5-propyl-1H-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one, (6E)-6-(2-phenyl-5-propyl-1H-1,2,4-triazol-3-ylidene)-1-cyclohexa-2,4-dienone
| Molecular Formula | C17H17N3O |
|---|---|
| Molecular Weight | 279.14 g/mol |
| LogP | 3.5924 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 279.13718 |
| Heavy Atoms | 21 |
| Complexity | 734.80096 |
Chemical Identifiers
| CAS Number | 120029-40-5 |
|---|---|
| SMILES | CCCC1=NN(C(=N1)C2=CC=CC=C2O)C3=CC=CC=C3 |
Product Overview
2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol (CAS 120029-40-5), with molecular formula C17H17N3O and molecular weight 279.14 g/mol. IUPAC: 2-(2-phenyl-5-propyl-1,2,4-triazol-3-yl)phenol.
Chemical Property Profile of 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol
Property Insights of 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol
The XLogP value of 3.5924 indicates that 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.94 Ų, 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol has 1 hydrogen bond donor(s) and 3 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 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol?
The CAS number of 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol is 120029-40-5.
What is the molecular formula of 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol?
The molecular formula of 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol is C17H17N3O.
What is the molecular weight of 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol?
The molecular weight of 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol is 279.14 g/mol.
Where can I buy 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol?
You can request a quote for 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-phenyl-3-propyl-1H-1,2,4-triazol-5-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.