4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol
TL;DR: 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol (CAS 49787-02-2) is a chemical compound with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-methyl-1,2,4-oxadiazol-3-yl)phenol
Also Known As: 4-(5-methyl-1,2,4-oxadiazol-3-yl)phenol, (3,5-Dimethyl-1H-pyrazol-1-yl)acetic acid, Phenol, 4-(5-methyl-1,2,4-oxadiazol-3-yl)-, 4-(5-methyl-[1,2,4]oxadiazol-3-yl)phenol, 4-(5-methyl-[1,2,4]oxadiazol-3-yl)-phenol
| Molecular Formula | C9H8N2O2 |
|---|---|
| Molecular Weight | 176.06 g/mol |
| LogP | 1.75062 |
| Topological Polar Surface Area | 59.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.05858 |
| Heavy Atoms | 13 |
| Complexity | 405.80798 |
Chemical Identifiers
| CAS Number | 49787-02-2 |
|---|---|
| SMILES | CC1=NC(=NO1)C2=CC=C(C=C2)O |
Product Overview
4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol (CAS 49787-02-2), with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol. IUPAC: 4-(5-methyl-1,2,4-oxadiazol-3-yl)phenol.
Chemical Property Profile of 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol
Property Insights of 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol
The XLogP value of 1.75062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol. With a topological polar surface area (TPSA) of 59.15 Ų, 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol has 1 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 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol?
The CAS number of 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol is 49787-02-2.
What is the molecular formula of 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol?
The molecular formula of 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol is C9H8N2O2.
What is the molecular weight of 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol?
The molecular weight of 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol is 176.06 g/mol.
Where can I buy 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol?
You can request a quote for 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-(5-Methyl-1,2,4-oxadiazol-3-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.