n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide
TL;DR: n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide (CAS 26490-07-3) is a chemical compound with molecular formula C30H30N10O9 and molecular weight 674.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N,6-N,10-N-tris(4-nitrophenyl)-2,6,10,13-tetrazatricyclo[7.3.1.05,13]tridecane-2,6,10-tricarboxamide
Also Known As: n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide, 2-N,6-N,10-N-tris(4-nitrophenyl)-2,6,10,13-tetrazatricyclo[7.3.1.05,13]tridecane-2,6,10-tricarboxamide, N~1~,N~4~,N~7~-Tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2H,5H,8H)-tricarboxamide
| Molecular Formula | C30H30N10O9 |
|---|---|
| Molecular Weight | 674.22 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 238.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 674.2197 |
| Heavy Atoms | 49 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 26490-07-3 |
|---|---|
| SMILES | C1CN(C2CCN(C3N2C1N(CC3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-])C(=O)NC5=CC=C(C=C5)[N+](=O)[O-])C(=O)NC6=CC=C(C=C6)[N+](=O)[O-] |
| InChIKey | OIPXTTTWAMSCDL-UHFFFAOYSA-N |
Product Overview
n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide (CAS 26490-07-3), with molecular formula C30H30N10O9 and molecular weight 674.22 g/mol. IUPAC: 2-N,6-N,10-N-tris(4-nitrophenyl)-2,6,10,13-tetrazatricyclo[7.3.1.05,13]tridecane-2,6,10-tricarboxamide.
Chemical Property Profile of n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide
Property Insights of n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide
The XLogP value of 3.3 indicates that n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 238.0 Ų indicates high polarity, suggesting n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide?
The CAS number of n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide is 26490-07-3.
What is the molecular formula of n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide?
The molecular formula of n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide is C30H30N10O9.
What is the molecular weight of n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide?
The molecular weight of n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide is 674.22 g/mol.
Where can I buy n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide?
You can request a quote for n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide?
Yes, KEHONG BIO provides custom synthesis services for n,n',n''-tris(4-nitrophenyl)hexahydro-1,4,7,9b-tetraazaphenalene-1,4,7(2h,5h,8h)-tricarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.