![ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate structure](/static/products/6476/64762-40-9.webp)
ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate
TL;DR: ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate (CAS 64762-40-9) is a chemical compound with molecular formula C24H25N3O3 and molecular weight 403.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate
Also Known As: ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate, Ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)[1,2,4]oxadiazolo[4,5-b][1,2]diazepine-5(9aH)-carboxylate
| Molecular Formula | C24H25N3O3 |
|---|---|
| Molecular Weight | 403.19 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.1896 |
| Heavy Atoms | 30 |
| Complexity | 713.0 |
Chemical Identifiers
| CAS Number | 64762-40-9 |
|---|---|
| SMILES | CCOC(=O)N1C=CC(=CC2N1C(=NO2)C3=C(C=C(C=C3C)C)C)C4=CC=CC=C4 |
| InChIKey | SGNWMBDIYHYRLC-UHFFFAOYSA-N |
Product Overview
ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate (CAS 64762-40-9), with molecular formula C24H25N3O3 and molecular weight 403.19 g/mol. IUPAC: ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate.
Chemical Property Profile of ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate
Property Insights of ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate
The XLogP value of 5.2 indicates that ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate?
The CAS number of ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate is 64762-40-9.
What is the molecular formula of ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate?
The molecular formula of ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate is C24H25N3O3.
What is the molecular weight of ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate?
The molecular weight of ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate is 403.19 g/mol.
Where can I buy ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate?
You can request a quote for ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 8-phenyl-3-(2,4,6-trimethylphenyl)-9aH-[1,2,4]oxadiazolo[4,5-b]diazepine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.