N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine
TL;DR: N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine (CAS 1033-84-7) is a chemical compound with molecular formula C11H9N3O5S and molecular weight 295.0263 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine
Also Known As: 3,5-dinitro-2-(4-methoxyphenyl)aminothiophene, N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine, J3.296.100B, N-(4-Methoxyphenyl)-3,5-dinitrothiophene-2-amine, N-(4-methoxyphenyl)-3,5-dinitro-thiophen-2-amine
Technical Specifications
| Molecular Formula | C11H9N3O5S |
| Molecular Weight | 295.0263 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 141.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.0263 Da |
| Heavy Atoms | 20 |
| Complexity | 364.0 |
| SMILES | COC1=CC=C(C=C1)NC2=C(C=C(S2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | RAMNLKVFJICHKJ-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine
Property Insights of N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine
The XLogP value of 4.0 indicates that N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine?
The CAS number of N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine is 1033-84-7.
What is the molecular formula of N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine?
The molecular formula of N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine is C11H9N3O5S.
What is the molecular weight of N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine?
The molecular weight of N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine is 295.0263 g/mol.
Where can I buy N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine?
You can request a quote for N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine?
Yes, CoreyChem provides custom synthesis services for N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.