![2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione structure](/static/products/6239/62391-06-4.webp)
2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
TL;DR: 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione (CAS 62391-06-4) is a chemical compound with molecular formula C16H10N2O8S and molecular weight 390.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
Also Known As: 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione, 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylid
| Molecular Formula | C16H10N2O8S |
|---|---|
| Molecular Weight | 390.02 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 172.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 390.01578 |
| Heavy Atoms | 27 |
| Complexity | 670.0 |
Chemical Identifiers
| CAS Number | 62391-06-4 |
|---|---|
| SMILES | CC1(OC(=O)C(=CC2=CC=C(S2)[N+](=O)[O-])C(=O)O1)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | DIGZUIAHVNZSSY-UHFFFAOYSA-N |
Product Overview
2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione (CAS 62391-06-4), with molecular formula C16H10N2O8S and molecular weight 390.02 g/mol. IUPAC: 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione.
Chemical Property Profile of 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
Property Insights of 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione
The XLogP value of 3.6 indicates that 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 172.0 Ų indicates high polarity, suggesting 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione has 0 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 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione?
The CAS number of 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione is 62391-06-4.
What is the molecular formula of 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione?
The molecular formula of 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione is C16H10N2O8S.
What is the molecular weight of 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione?
The molecular weight of 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione is 390.02 g/mol.
Where can I buy 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione?
You can request a quote for 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-2-(4-nitrophenyl)-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.