5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one
TL;DR: 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one (CAS 119933-32-3) 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.
5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one
Also Known As: 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one, US11634391, Compound 108, 1,3,4-Oxadiazol-2(3H)-one, 5-(2-methylphenyl)-, 5-o-Tolyl-[1,3,4]oxadiazol-2-ol, 5-(o-tolyl)-1,3,4-oxadiazol-2-ol
| Molecular Formula | C9H8N2O2 |
|---|---|
| Molecular Weight | 176.06 g/mol |
| LogP | 1.33832 |
| Topological Polar Surface Area | 58.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.05858 |
| Heavy Atoms | 13 |
| Complexity | 470.21698 |
Chemical Identifiers
| CAS Number | 119933-32-3 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NNC(=O)O2 |
Product Overview
5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one (CAS 119933-32-3), with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol. IUPAC: 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one.
Chemical Property Profile of 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one
Property Insights of 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one
The XLogP value of 1.33832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one. With a topological polar surface area (TPSA) of 58.89 Ų, 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one 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 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one?
The CAS number of 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one is 119933-32-3.
What is the molecular formula of 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one?
The molecular formula of 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one is C9H8N2O2.
What is the molecular weight of 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one?
The molecular weight of 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one is 176.06 g/mol.
Where can I buy 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one?
You can request a quote for 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-methylphenyl)-3H-1,3,4-oxadiazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.