Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-
TL;DR: Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)- (CAS 5378-31-4) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-butoxyphenyl)-1,3,4-oxadiazole
Also Known As: 2-(3-butoxyphenyl)-1,3,4-oxadiazole, Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-, Oxadiazole,1,3,4-,2- -,, 2-(3-butoxy-phenyl)-[1,3,4]oxadiazole, Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-,
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 48.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 5378-31-4 |
|---|---|
| SMILES | CCCCOC1=CC=CC(=C1)C2=NN=CO2 |
| InChIKey | IHLRVUVFLZABKK-UHFFFAOYSA-N |
Product Overview
Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)- (CAS 5378-31-4), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: 2-(3-butoxyphenyl)-1,3,4-oxadiazole.
Chemical Property Profile of Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-
Property Insights of Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-. With a topological polar surface area (TPSA) of 48.2 Ų, Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)- 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 Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-?
The CAS number of Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)- is 5378-31-4.
What is the molecular formula of Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-?
The molecular formula of Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)- is C12H14N2O2.
What is the molecular weight of Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-?
The molecular weight of Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)- is 218.11 g/mol.
Where can I buy Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-?
You can request a quote for Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Oxadiazole, 1,3,4-, 2-(m-butoxyphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.