![4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide structure](/static/products/690/690651-49-1.png)
4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide
TL;DR: 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide (CAS 690651-49-1) is a chemical compound with molecular formula C13H11N3O4S and molecular weight 305.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-[amino-(4-nitrophenyl)methylidene]amino] 2-thiophen-2-ylacetate
Also Known As: 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide, [(Z)-[amino-(4-nitrophenyl)methylidene]amino] 2-thiophen-2-ylacetate, 4-nitro-N'-[(2-thienylacetyl)oxy]benzenecarboximidamide, 2-thiophen-2-ylacetic acid [[amino-(4-nitrophenyl)methylidene]amino] ester, REGID_for_CID_5863100
| Molecular Formula | C13H11N3O4S |
|---|---|
| Molecular Weight | 305.05 g/mol |
| LogP | 2.0625 |
| Topological Polar Surface Area | 107.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.04703 |
| Heavy Atoms | 21 |
| Complexity | 665.2346 |
Chemical Identifiers
| CAS Number | 690651-49-1 |
|---|---|
| SMILES | C1=CSC(=C1)CC(=O)O/N=C(/C2=CC=C(C=C2)[N+](=O)[O-])\N |
Product Overview
4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide (CAS 690651-49-1), with molecular formula C13H11N3O4S and molecular weight 305.05 g/mol. IUPAC: [(Z)-[amino-(4-nitrophenyl)methylidene]amino] 2-thiophen-2-ylacetate.
Chemical Property Profile of 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide
Property Insights of 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide
The XLogP value of 2.0625 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide. The TPSA of 107.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide. Following Lipinski's Rule of Five, 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide has 1 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 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide?
The CAS number of 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide is 690651-49-1.
What is the molecular formula of 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide?
The molecular formula of 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide is C13H11N3O4S.
What is the molecular weight of 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide?
The molecular weight of 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide is 305.05 g/mol.
Where can I buy 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide?
You can request a quote for 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-N'-[(thiophen-2-ylacetyl)oxy]benzenecarboximidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.