1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-
TL;DR: 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)- (CAS 292870-06-5) is a chemical compound with molecular formula C14H17N5O2 and molecular weight 287.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-N-(1,3,5-triazatricyclo[3.3.1.13,7]decan-7-yl)methanimine
Also Known As: 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-, (1s,3s,5s,E)-N-(4-nitrobenzylidene)-1,3,5-triazaadamantan-7-amine, 7-({4-nitrobenzylidene}amino)-1,3,5-triazatricyclo[3.3.1.1~3,7~]decane, N-[(E)-(4-nitrophenyl)methylidene]-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine
| Molecular Formula | C14H17N5O2 |
|---|---|
| Molecular Weight | 287.14 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.1382 |
| Heavy Atoms | 21 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 292870-06-5 |
|---|---|
| SMILES | C1C2(CN3CN1CN(C2)C3)N=CC4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | IMFKAMKQDAZJEM-UHFFFAOYSA-N |
Product Overview
1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)- (CAS 292870-06-5), with molecular formula C14H17N5O2 and molecular weight 287.14 g/mol. IUPAC: 1-(4-nitrophenyl)-N-(1,3,5-triazatricyclo[3.3.1.13,7]decan-7-yl)methanimine.
Chemical Property Profile of 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-
Property Insights of 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-. Following Lipinski's Rule of Five, 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)- has 0 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 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-?
The CAS number of 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)- is 292870-06-5.
What is the molecular formula of 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-?
The molecular formula of 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)- is C14H17N5O2.
What is the molecular weight of 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-?
The molecular weight of 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)- is 287.14 g/mol.
Where can I buy 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-?
You can request a quote for 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Triazaadamantane, 7-(4-nitrobenzlidenamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.