Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester
TL;DR: Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester (CAS 312504-96-4) is a chemical compound with molecular formula C16H18N2O2S2 and molecular weight 334.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2Z)-2-(phenylhydrazinylidene)-2-thiophen-2-ylethyl]sulfanylacetate
Also Known As: BAS 01507341, A1917/0080565, (Z)-ethyl 2-((2-(2-phenylhydrazono)-2-(thiophen-2-yl)ethyl)thio)acetate, Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester, Ethyl ([(2Z)-2-(phenylhydrazono)-2-(2-thienyl)ethyl]sulfanyl)acetate #
| Molecular Formula | C16H18N2O2S2 |
|---|---|
| Molecular Weight | 334.08 g/mol |
| LogP | 3.8606 |
| Topological Polar Surface Area | 50.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 334.08096 |
| Heavy Atoms | 22 |
| Complexity | 597.87305 |
Chemical Identifiers
| CAS Number | 312504-96-4 |
|---|---|
| SMILES | CCOC(=O)CSC/C(=N/NC1=CC=CC=C1)/C2=CC=CS2 |
Product Overview
Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester (CAS 312504-96-4), with molecular formula C16H18N2O2S2 and molecular weight 334.08 g/mol. IUPAC: ethyl 2-[(2Z)-2-(phenylhydrazinylidene)-2-thiophen-2-ylethyl]sulfanylacetate.
Chemical Property Profile of Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester
Property Insights of Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester
The XLogP value of 3.8606 indicates that Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.69 Ų, Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester has 1 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 Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester?
The CAS number of Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester is 312504-96-4.
What is the molecular formula of Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester?
The molecular formula of Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester is C16H18N2O2S2.
What is the molecular weight of Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester?
The molecular weight of Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester is 334.08 g/mol.
Where can I buy Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester?
You can request a quote for Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, 2-[2-phenylhydrazono-2-(2-thienyl)ethylthio]-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.