1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester
TL;DR: 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester (CAS 380487-05-8) is a chemical compound with molecular formula C18H23NO4 and molecular weight 317.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(furan-2-ylmethylamino)-2-oxoethyl] adamantane-1-carboxylate
Also Known As: IDI1_007106, [2-(furan-2-ylmethylamino)-2-oxoethyl] adamantane-1-carboxylate, 2-((Furan-2-ylmethyl)amino)-2-oxoethyl adamantane-1-carboxylate, 1-adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester, [2-(2-furylmethylamino)-2-oxo-ethyl] adamantane-1-carboxylate
| Molecular Formula | C18H23NO4 |
|---|---|
| Molecular Weight | 317.16 g/mol |
| LogP | 2.6554 |
| Topological Polar Surface Area | 68.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 317.16272 |
| Heavy Atoms | 23 |
| Complexity | 556.88837 |
Chemical Identifiers
| CAS Number | 380487-05-8 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)OCC(=O)NCC4=CC=CO4 |
Product Overview
1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester (CAS 380487-05-8), with molecular formula C18H23NO4 and molecular weight 317.16 g/mol. IUPAC: [2-(furan-2-ylmethylamino)-2-oxoethyl] adamantane-1-carboxylate.
Chemical Property Profile of 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester
Property Insights of 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester
The XLogP value of 2.6554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester. The TPSA of 68.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester. Following Lipinski's Rule of Five, 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester has 1 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-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester?
The CAS number of 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester is 380487-05-8.
What is the molecular formula of 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester?
The molecular formula of 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester is C18H23NO4.
What is the molecular weight of 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester?
The molecular weight of 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester is 317.16 g/mol.
Where can I buy 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester?
You can request a quote for 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester?
Yes, KEHONG BIO provides custom synthesis services for 1-Adamantanecarboxylic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.