9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine
TL;DR: 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine (CAS 140866-77-9) is a chemical compound with molecular formula C26H28ClN3O5 and molecular weight 497.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(acridin-9-ylamino)hexyl 4-nitrobenzoate;hydrate;hydrochloride
Also Known As: 9-Nhaa, 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine, 6-(acridin-9-ylamino)hexyl 4-nitrobenzoate;hydrate;hydrochloride, 1-Hexanol, 6-(9-acridinylamino)-, 4-nitrobenzoate (ester), monohydrochloride, monohydrate, 6-(acridin-9-ylamino)hexyl 4-nitrobenzoate hydrate hydrochloride
| Molecular Formula | C26H28ClN3O5 |
|---|---|
| Molecular Weight | 497.17 g/mol |
| LogP | 5.7226 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 497.17175 |
| Heavy Atoms | 35 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 140866-77-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCCCOC(=O)C4=CC=C(C=C4)[N+](=O)[O-].O.Cl |
| InChIKey | UQMUBMVZGWTUPJ-UHFFFAOYSA-N |
Product Overview
9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine (CAS 140866-77-9), with molecular formula C26H28ClN3O5 and molecular weight 497.17 g/mol. IUPAC: 6-(acridin-9-ylamino)hexyl 4-nitrobenzoate;hydrate;hydrochloride.
Chemical Property Profile of 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine
Property Insights of 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine
The XLogP value of 5.7226 indicates that 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine. Following Lipinski's Rule of Five, 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine?
The CAS number of 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine is 140866-77-9.
What is the molecular formula of 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine?
The molecular formula of 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine is C26H28ClN3O5.
What is the molecular weight of 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine?
The molecular weight of 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine is 497.17 g/mol.
Where can I buy 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine?
You can request a quote for 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine?
Yes, KEHONG BIO provides custom synthesis services for 9-((6-(4-Nitrobenzoyloxy)hexyl)amino)acridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.