1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-
TL;DR: 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy- (CAS 39636-00-5) is a chemical compound with molecular formula C5H8N2O3 and molecular weight 144.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-5-methoxy-1,3,4-oxadiazol-2-one
Also Known As: 3-Ethyl-5-methoxy-1,3,4-oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-1,3,4-oxadiazol-2-one, 3-ethyl-5-methoxy-3H-[1,3,4]oxadiazol-2-one, 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-, 3-Ethyl-5-methoxy-1,3,4-oxadiazol-2(3H)-one #
| Molecular Formula | C5H8N2O3 |
|---|---|
| Molecular Weight | 144.05 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 51.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 144.0535 |
| Heavy Atoms | 10 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 39636-00-5 |
|---|---|
| SMILES | CCN1C(=O)OC(=N1)OC |
| InChIKey | WVFODOFLRBFRTI-UHFFFAOYSA-N |
Product Overview
1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy- (CAS 39636-00-5), with molecular formula C5H8N2O3 and molecular weight 144.05 g/mol. IUPAC: 3-ethyl-5-methoxy-1,3,4-oxadiazol-2-one.
Chemical Property Profile of 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-
Property Insights of 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-. With a topological polar surface area (TPSA) of 51.1 Ų, 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy- 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 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-?
The CAS number of 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy- is 39636-00-5.
What is the molecular formula of 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-?
The molecular formula of 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy- is C5H8N2O3.
What is the molecular weight of 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-?
The molecular weight of 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy- is 144.05 g/mol.
Where can I buy 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-?
You can request a quote for 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Oxadiazol-2(3H)-one, 3-ethyl-5-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.