N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide
TL;DR: N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide (CAS 79798-92-8) is a chemical compound with molecular formula C14H11N5O7S and molecular weight 393.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-acetyl-3-(2-amino-2-oxoethyl)-5-nitrothiophen-2-ylidene]-4-nitropyridine-2-carboxamide
Also Known As: 2-(2-(3-Nitrobenzoylimino)-5-nitro-4-thiazolin-3-yl)diacetamide, N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide, 3(2H)-Thiazoleacetamide, N-acetyl-2-((3-nitrobenzol)imino)-5-nitro-, N-[(2Z)-3-Acetyl-3-(2-amino-2-oxoethyl)-5-nitro-2(3H)-thiophenyli dene]-4-nitro-2-pyridinecarboxamide, N-[3-acetyl-3-(2-amino-2-oxoethyl)-5-nitrothiophen-2-ylidene]-4-nitropyridine-2-carboxamide
| Molecular Formula | C14H11N5O7S |
|---|---|
| Molecular Weight | 393.04 g/mol |
| LogP | 0.8442 |
| Topological Polar Surface Area | 188.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 393.03793 |
| Heavy Atoms | 27 |
| Complexity | 941.5388 |
Chemical Identifiers
| CAS Number | 79798-92-8 |
|---|---|
| SMILES | CC(=O)C1(C=C(SC1=NC(=O)C2=NC=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])CC(=O)N |
Product Overview
N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide (CAS 79798-92-8), with molecular formula C14H11N5O7S and molecular weight 393.04 g/mol. IUPAC: N-[3-acetyl-3-(2-amino-2-oxoethyl)-5-nitrothiophen-2-ylidene]-4-nitropyridine-2-carboxamide.
Chemical Property Profile of N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide
Property Insights of N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide
The XLogP value of 0.8442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide. The TPSA of 188.76 Ų indicates high polarity, suggesting N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide has 1 hydrogen bond donor(s) and 9 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-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide?
The CAS number of N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide is 79798-92-8.
What is the molecular formula of N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide?
The molecular formula of N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide is C14H11N5O7S.
What is the molecular weight of N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide?
The molecular weight of N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide is 393.04 g/mol.
Where can I buy N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide?
You can request a quote for N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-Acetyl-2-((3-nitrobenzoyl)imino)-5-nitro-3(2H)-thiazoleacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.