1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)-
TL;DR: 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)- (CAS 105873-94-7) is a chemical compound with molecular formula C10H11N3O and molecular weight 189.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[methoxy(phenyl)methyl]-1,2,4-triazole
Also Known As: 1-[methoxy(phenyl)methyl]-1,2,4-triazole, 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)-, 3-Hydroxy-2-methoxycyclohex-2-en-1-on, 1-(methoxy-phenyl-methyl)-1,2,4-triazole, 1-[Methoxy(phenyl)methyl]-1H-1,2,4-triazole
| Molecular Formula | C10H11N3O |
|---|---|
| Molecular Weight | 189.09 g/mol |
| LogP | 1.4714 |
| Topological Polar Surface Area | 39.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 189.09021 |
| Heavy Atoms | 14 |
| Complexity | 371.53033 |
Chemical Identifiers
| CAS Number | 105873-94-7 |
|---|---|
| SMILES | COC(C1=CC=CC=C1)N2C=NC=N2 |
Product Overview
1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)- (CAS 105873-94-7), with molecular formula C10H11N3O and molecular weight 189.09 g/mol. IUPAC: 1-[methoxy(phenyl)methyl]-1,2,4-triazole.
Chemical Property Profile of 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)-
Property Insights of 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)-
The XLogP value of 1.4714 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)-. With a topological polar surface area (TPSA) of 39.94 Ų, 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)- has 0 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 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)-?
The CAS number of 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)- is 105873-94-7.
What is the molecular formula of 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)-?
The molecular formula of 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)- is C10H11N3O.
What is the molecular weight of 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)-?
The molecular weight of 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)- is 189.09 g/mol.
Where can I buy 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)-?
You can request a quote for 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,4-Triazole, 1-(methoxyphenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.