[2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate
TL;DR: [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate (CAS 385403-37-2) is a chemical compound with molecular formula C17H20N2O6 and molecular weight 348.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(1-adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate
Also Known As: J2.822.745K, [(adamantan-1-yl)carbamoyl]methyl5-nitrofuran-2-carboxylate, [2-(1-adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate, [(adamantan-1-yl)carbamoyl]methyl 5-nitrofuran-2-carboxylate, [2-(1-adamantylamino)-2-oxo-ethyl] 5-nitrofuran-2-carboxylate
| Molecular Formula | C17H20N2O6 |
|---|---|
| Molecular Weight | 348.13 g/mol |
| LogP | 2.4296 |
| Topological Polar Surface Area | 111.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.13214 |
| Heavy Atoms | 25 |
| Complexity | 689.191 |
Chemical Identifiers
| CAS Number | 385403-37-2 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=CC=C(O4)[N+](=O)[O-] |
Product Overview
[2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate (CAS 385403-37-2), with molecular formula C17H20N2O6 and molecular weight 348.13 g/mol. IUPAC: [2-(1-adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate.
Chemical Property Profile of [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate
Property Insights of [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate
The XLogP value of 2.4296 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate. The TPSA of 111.68 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate. Following Lipinski's Rule of Five, [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate has 1 hydrogen bond donor(s) and 6 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 [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate?
The CAS number of [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate is 385403-37-2.
What is the molecular formula of [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate?
The molecular formula of [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate is C17H20N2O6.
What is the molecular weight of [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate?
The molecular weight of [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate is 348.13 g/mol.
Where can I buy [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate?
You can request a quote for [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(1-Adamantylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.