N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide
TL;DR: N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide (CAS 866135-69-5) is a chemical compound with molecular formula C13H16N4O and molecular weight 244.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-phenylpropyl)-2-(1,2,4-triazol-1-yl)acetamide
Also Known As: N-(3-phenylpropyl)-2-(1H-1,2,4-triazol-1-yl)acetamide, N-(3-phenylpropyl)-2-(1,2,4-triazol-1-yl)acetamide, N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide, RefChem:361496
| Molecular Formula | C13H16N4O |
|---|---|
| Molecular Weight | 244.13 g/mol |
| LogP | 1.0271 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 244.13242 |
| Heavy Atoms | 18 |
| Complexity | 467.00116 |
Chemical Identifiers
| CAS Number | 866135-69-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCNC(=O)CN2C=NC=N2 |
Product Overview
N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide (CAS 866135-69-5), with molecular formula C13H16N4O and molecular weight 244.13 g/mol. IUPAC: N-(3-phenylpropyl)-2-(1,2,4-triazol-1-yl)acetamide.
Chemical Property Profile of N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide
Property Insights of N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide
The XLogP value of 1.0271 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide. With a topological polar surface area (TPSA) of 59.81 Ų, N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide 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 N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide?
The CAS number of N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide is 866135-69-5.
What is the molecular formula of N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide?
The molecular formula of N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide is C13H16N4O.
What is the molecular weight of N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide?
The molecular weight of N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide is 244.13 g/mol.
Where can I buy N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide?
You can request a quote for N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Phenylpropyl)-1H-1,2,4-triazole-1-acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.