(1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate
TL;DR: (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate (CAS 338757-30-5) is a chemical compound with molecular formula C13H13N3O2 and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-phenyltriazol-4-yl)methyl cyclopropanecarboxylate
Also Known As: 5F-350S, (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate, (1-phenyltriazol-4-yl)methyl cyclopropanecarboxylate
| Molecular Formula | C13H13N3O2 |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 1.7205 |
| Topological Polar Surface Area | 57.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.10077 |
| Heavy Atoms | 18 |
| Complexity | 546.37384 |
Chemical Identifiers
| CAS Number | 338757-30-5 |
|---|---|
| SMILES | C1CC1C(=O)OCC2=CN(N=N2)C3=CC=CC=C3 |
Product Overview
(1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate (CAS 338757-30-5), with molecular formula C13H13N3O2 and molecular weight 243.10 g/mol. IUPAC: (1-phenyltriazol-4-yl)methyl cyclopropanecarboxylate.
Chemical Property Profile of (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate
Property Insights of (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate
The XLogP value of 1.7205 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate. With a topological polar surface area (TPSA) of 57.01 Ų, (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate has 0 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 (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate?
The CAS number of (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate is 338757-30-5.
What is the molecular formula of (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate?
The molecular formula of (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate is C13H13N3O2.
What is the molecular weight of (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate?
The molecular weight of (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate is 243.10 g/mol.
Where can I buy (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate?
You can request a quote for (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for (1-phenyl-1H-1,2,3-triazol-4-yl)methyl cyclopropanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.