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N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide
TL;DR: N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide (CAS 302941-04-4) is a chemical compound with molecular formula C19H23N3O5 and molecular weight 373.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide
Also Known As: N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide, N-[1-(adamantan-1-yl)ethyl]-3,5-dinitrobenzamide, F0011-0506, N-[1-(1-adamantanyl)ethyl]3,5-dinitrobenzamide, N-(1-((3r,5r,7r)-adamantan-1-yl)ethyl)-3,5-dinitrobenzamide
| Molecular Formula | C19H23N3O5 |
|---|---|
| Molecular Weight | 373.16 g/mol |
| LogP | 3.8377 |
| Topological Polar Surface Area | 115.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.16376 |
| Heavy Atoms | 27 |
| Complexity | 754.029 |
Chemical Identifiers
| CAS Number | 302941-04-4 |
|---|---|
| SMILES | CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide (CAS 302941-04-4), with molecular formula C19H23N3O5 and molecular weight 373.16 g/mol. IUPAC: N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide.
Chemical Property Profile of N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide
Property Insights of N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide
The XLogP value of 3.8377 indicates that N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.38 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide. Following Lipinski's Rule of Five, N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide has 1 hydrogen bond donor(s) and 5 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 N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide?
The CAS number of N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide is 302941-04-4.
What is the molecular formula of N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide?
The molecular formula of N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide is C19H23N3O5.
What is the molecular weight of N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide?
The molecular weight of N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide is 373.16 g/mol.
Where can I buy N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide?
You can request a quote for N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[1-(1-adamantyl)ethyl]-3,5-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.