N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide
TL;DR: N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide (CAS 498535-95-8) is a chemical compound with molecular formula C21H17N3O4 and molecular weight 375.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-[amino-(3-nitrophenyl)methylidene]amino] 2-(4-phenylphenyl)acetate
Also Known As: N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide, N'-[(biphenyl-4-ylacetyl)oxy]-3-nitrobenzenecarboximidamide, (Z)-N'-(2-([1,1'-biphenyl]-4-yl)acetoxy)-3-nitrobenzimidamide
| Molecular Formula | C21H17N3O4 |
|---|---|
| Molecular Weight | 375.12 g/mol |
| LogP | 3.668 |
| Topological Polar Surface Area | 107.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.12192 |
| Heavy Atoms | 28 |
| Complexity | 1015.3354 |
Chemical Identifiers
| CAS Number | 498535-95-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)O/N=C(/C3=CC(=CC=C3)[N+](=O)[O-])\N |
Product Overview
N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide (CAS 498535-95-8), with molecular formula C21H17N3O4 and molecular weight 375.12 g/mol. IUPAC: [(Z)-[amino-(3-nitrophenyl)methylidene]amino] 2-(4-phenylphenyl)acetate.
Chemical Property Profile of N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide
Property Insights of N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide
The XLogP value of 3.668 indicates that N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.82 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide. Following Lipinski's Rule of Five, N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide has 1 hydrogen bond donor(s) and 5 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 N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide?
The CAS number of N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide is 498535-95-8.
What is the molecular formula of N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide?
The molecular formula of N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide is C21H17N3O4.
What is the molecular weight of N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide?
The molecular weight of N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide is 375.12 g/mol.
Where can I buy N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide?
You can request a quote for N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide?
Yes, KEHONG BIO provides custom synthesis services for N'-[(4-biphenylylacetyl)oxy]-3-nitrobenzenecarboximidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.