ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden
TL;DR: ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden (CAS 83132-58-5) is a chemical compound with molecular formula C17H15ClN4O5S and molecular weight 422.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[6-chloro-2-[1-(5-nitrofuran-2-yl)ethylidenehydrazinylidene]-1,3-benzothiazol-3-yl]acetate
Also Known As: ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden, ethyl 2-[6-chloro-2-[1-(5-nitrofuran-2-yl)ethylidenehydrazinylidene]-1,3-benzothiazol-3-yl]acetate
| Molecular Formula | C17H15ClN4O5S |
|---|---|
| Molecular Weight | 422.05 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 422.04517 |
| Heavy Atoms | 28 |
| Complexity | 670.0 |
Chemical Identifiers
| CAS Number | 83132-58-5 |
|---|---|
| SMILES | CCOC(=O)CN1C2=C(C=C(C=C2)Cl)SC1=NN=C(C)C3=CC=C(O3)[N+](=O)[O-] |
| InChIKey | ULRZNFFEHNKEAX-UHFFFAOYSA-N |
Product Overview
ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden (CAS 83132-58-5), with molecular formula C17H15ClN4O5S and molecular weight 422.05 g/mol. IUPAC: ethyl 2-[6-chloro-2-[1-(5-nitrofuran-2-yl)ethylidenehydrazinylidene]-1,3-benzothiazol-3-yl]acetate.
Chemical Property Profile of ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden
Property Insights of ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden
The XLogP value of 4.5 indicates that ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden. Following Lipinski's Rule of Five, ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden has 0 hydrogen bond donor(s) and 8 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 ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden?
The CAS number of ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden is 83132-58-5.
What is the molecular formula of ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden?
The molecular formula of ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden is C17H15ClN4O5S.
What is the molecular weight of ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden?
The molecular weight of ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden is 422.05 g/mol.
Where can I buy ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden?
You can request a quote for ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[(2Z)-6-chloro-2-[(E)-1-(5-nitrofuran-2-yl)ethyliden and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.