Guanidine, N,N',N''-tris(4-nitrophenyl)-
TL;DR: Guanidine, N,N',N''-tris(4-nitrophenyl)- (CAS 18440-30-7) is a chemical compound with molecular formula C19H14N6O6 and molecular weight 422.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3-tris(4-nitrophenyl)guanidine
Also Known As: 1,2,3-tris(4-nitrophenyl)guanidine, N,N',N''-Tris(p-nitrophenyl)guanidine, Guanidine, N,N',N''-tris(4-nitrophenyl)-, N,N',N''-Tris(4-nitrophenyl)guanidine, Guanidine, N,N inverted exclamation mark(R),N inverted exclamation mark(R) inverted exclamation mark(R)-tris(4-nitrophenyl)-
| Molecular Formula | C19H14N6O6 |
|---|---|
| Molecular Weight | 422.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 174.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 422.09747 |
| Heavy Atoms | 31 |
| Complexity | 625.0 |
Chemical Identifiers
| CAS Number | 18440-30-7 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=NC2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | CDBWRGOFBAPWQM-UHFFFAOYSA-N |
Product Overview
Guanidine, N,N',N''-tris(4-nitrophenyl)- (CAS 18440-30-7), with molecular formula C19H14N6O6 and molecular weight 422.10 g/mol. IUPAC: 1,2,3-tris(4-nitrophenyl)guanidine.
Chemical Property Profile of Guanidine, N,N',N''-tris(4-nitrophenyl)-
Property Insights of Guanidine, N,N',N''-tris(4-nitrophenyl)-
The XLogP value of 3.8 indicates that Guanidine, N,N',N''-tris(4-nitrophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 174.0 Ų indicates high polarity, suggesting Guanidine, N,N',N''-tris(4-nitrophenyl)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Guanidine, N,N',N''-tris(4-nitrophenyl)- has 2 hydrogen bond donor(s) and 7 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 Guanidine, N,N',N''-tris(4-nitrophenyl)-?
The CAS number of Guanidine, N,N',N''-tris(4-nitrophenyl)- is 18440-30-7.
What is the molecular formula of Guanidine, N,N',N''-tris(4-nitrophenyl)-?
The molecular formula of Guanidine, N,N',N''-tris(4-nitrophenyl)- is C19H14N6O6.
What is the molecular weight of Guanidine, N,N',N''-tris(4-nitrophenyl)-?
The molecular weight of Guanidine, N,N',N''-tris(4-nitrophenyl)- is 422.10 g/mol.
Where can I buy Guanidine, N,N',N''-tris(4-nitrophenyl)-?
You can request a quote for Guanidine, N,N',N''-tris(4-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, N,N',N''-tris(4-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, N,N',N''-tris(4-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.