![Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate structure](/static/products/1257/125736-18-7.webp)
Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate
TL;DR: Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate (CAS 125736-18-7) is a chemical compound with molecular formula C17H26N2O4 and molecular weight 322.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl (1R)-2-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-2-ene-9-carboxylate
Also Known As: Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate, 9-Azabicyclo(4.2.1)non-2-ene-9-carboxylic acid, 2-(2-isoxazolidinylcarbonyl)-, 1,1-dimethylethyl ester, (1R)-, tert-Butyl 2-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-2-ene-9-carboxylate, 9-Azabicyclo(4.2.1)non-2-ene-9-carboxylic acid,2-(2-isoxazolidinylcarbonyl)-,1,1-dimethylethyl ester,(1R), TERT-BUTYL (1R)-2-(1,2-OXAZOLIDINE-2-CARBONYL)-9-AZABICYCLO[4.2.1]NON-2-ENE-9-CARBOXYLATE
| Molecular Formula | C17H26N2O4 |
|---|---|
| Molecular Weight | 322.19 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.18927 |
| Heavy Atoms | 23 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 125736-18-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1[C@@H]2CCC1CCC=C2C(=O)N3CCCO3 |
| InChIKey | YDTKYEJJXCZULX-TYZXPVIJSA-N |
Product Overview
Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate (CAS 125736-18-7), with molecular formula C17H26N2O4 and molecular weight 322.19 g/mol. IUPAC: tert-butyl (1R)-2-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-2-ene-9-carboxylate.
Chemical Property Profile of Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate
Property Insights of Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate. With a topological polar surface area (TPSA) of 59.1 Ų, Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate 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 Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate?
The CAS number of Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate is 125736-18-7.
What is the molecular formula of Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate?
The molecular formula of Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate is C17H26N2O4.
What is the molecular weight of Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate?
The molecular weight of Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate is 322.19 g/mol.
Where can I buy Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate?
You can request a quote for Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl (6R)-5-(1,2-oxazolidine-2-carbonyl)-9-azabicyclo[4.2.1]non-4-ene-9-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.