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 295.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C11H9N3O5S |
|---|---|
| Molecular Weight | 295.03 g/mol |
| LogP | 3.3167 |
| Topological Polar Surface Area | 107.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.0263 |
| Heavy Atoms | 20 |
| Complexity | 652.57825 |
Chemical Identifiers
| CAS Number | 1033-84-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC2=C(C=C(S2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine (CAS 1033-84-7), with molecular formula C11H9N3O5S and molecular weight 295.03 g/mol. IUPAC: N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine.
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 3.3167 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 107.54 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine. 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
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 295.03 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methoxyphenyl)-3,5-dinitrothiophen-2-amine?
Yes, KEHONG BIO 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.