![[amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate structure](/static/products/671/671754-59-9.png)
[amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate
TL;DR: [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate (CAS 671754-59-9) is a chemical compound with molecular formula C12H9ClN4O4S and molecular weight 340.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-[amino-(5-nitrothiophen-3-yl)methylidene]amino] N-(4-chlorophenyl)carbamate
Also Known As: [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate, [(E)-[amino-(5-nitrothiophen-3-yl)methylidene]amino] N-(4-chlorophenyl)carbamate
| Molecular Formula | C12H9ClN4O4S |
|---|---|
| Molecular Weight | 340.00 g/mol |
| LogP | 3.1787 |
| Topological Polar Surface Area | 119.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.0033 |
| Heavy Atoms | 22 |
| Complexity | 728.9824 |
Chemical Identifiers
| CAS Number | 671754-59-9 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)O/N=C(\C2=CSC(=C2)[N+](=O)[O-])/N)Cl |
Product Overview
[amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate (CAS 671754-59-9), with molecular formula C12H9ClN4O4S and molecular weight 340.00 g/mol. IUPAC: [(E)-[amino-(5-nitrothiophen-3-yl)methylidene]amino] N-(4-chlorophenyl)carbamate.
Chemical Property Profile of [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate
Property Insights of [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate
The XLogP value of 3.1787 indicates that [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.85 Ų falls within the moderate polarity range, balancing permeability and solubility for [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate. Following Lipinski's Rule of Five, [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate has 2 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 [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate?
The CAS number of [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate is 671754-59-9.
What is the molecular formula of [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate?
The molecular formula of [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate is C12H9ClN4O4S.
What is the molecular weight of [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate?
The molecular weight of [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate is 340.00 g/mol.
Where can I buy [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate?
You can request a quote for [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for [amino(5-nitrothiophen-3-yl)methylidene]amino N-(4-chlorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.