![2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide structure](/static/products/854/85469-95-0.png)
2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide
TL;DR: 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide (CAS 85469-95-0) is a chemical compound with molecular formula C17H19ClN2O3 and molecular weight 334.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantyl)-2-chloro-5-nitrobenzamide
Also Known As: N-(1-adamantyl)-2-chloro-5-nitrobenzamide, N-1-adamantyl-2-chloro-5-nitrobenzamide, N-(adamantan-1-yl)-2-chloro-5-nitrobenzamide, 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide, N-adamantanyl(2-chloro-5-nitrophenyl)carboxamide
| Molecular Formula | C17H19ClN2O3 |
|---|---|
| Molecular Weight | 334.11 g/mol |
| LogP | 3.9468 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.10843 |
| Heavy Atoms | 23 |
| Complexity | 653.1319 |
Chemical Identifiers
| CAS Number | 85469-95-0 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl |
Product Overview
2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide (CAS 85469-95-0), with molecular formula C17H19ClN2O3 and molecular weight 334.11 g/mol. IUPAC: N-(1-adamantyl)-2-chloro-5-nitrobenzamide.
Chemical Property Profile of 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide
Property Insights of 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide
The XLogP value of 3.9468 indicates that 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide. Following Lipinski's Rule of Five, 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide has 1 hydrogen bond donor(s) and 3 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-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide?
The CAS number of 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide is 85469-95-0.
What is the molecular formula of 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide?
The molecular formula of 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide is C17H19ClN2O3.
What is the molecular weight of 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide?
The molecular weight of 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide is 334.11 g/mol.
Where can I buy 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide?
You can request a quote for 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5-nitro-N-tricyclo[3.3.1.13,7]dec-1-ylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.