![methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate structure](/static/products/497/497079-68-2.png)
methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate
TL;DR: methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate (CAS 497079-68-2) is a chemical compound with molecular formula C16H14N4O4S and molecular weight 358.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[[3-(carbamothioyldiazenyl)-2-hydroxyindol-1-yl]methyl]furan-2-carboxylate
Also Known As: methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate, (Z)-methyl 5-((3-(2-carbamothioylhydrazono)-2-oxoindolin-1-yl)methyl)furan-2-carboxylate, methyl 5-[[3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate, 5-[[(3Z)-2-keto-3-(thiocarbamoylhydrazono)indolin-1-yl]methyl]furan-2-carboxylic acid methyl ester, 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxo-1-indolyl]methyl]-2-furancarboxylic acid methyl ester
| Molecular Formula | C16H14N4O4S |
|---|---|
| Molecular Weight | 358.07 g/mol |
| LogP | 3.1021 |
| Topological Polar Surface Area | 115.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.07358 |
| Heavy Atoms | 25 |
| Complexity | 989.34955 |
Chemical Identifiers
| CAS Number | 497079-68-2 |
|---|---|
| SMILES | COC(=O)C1=CC=C(O1)CN2C3=CC=CC=C3C(=C2O)N=NC(=S)N |
Product Overview
methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate (CAS 497079-68-2), with molecular formula C16H14N4O4S and molecular weight 358.07 g/mol. IUPAC: methyl 5-[[3-(carbamothioyldiazenyl)-2-hydroxyindol-1-yl]methyl]furan-2-carboxylate.
Chemical Property Profile of methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate
Property Insights of methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate
The XLogP value of 3.1021 indicates that methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.34 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate. Following Lipinski's Rule of Five, methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate 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 methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate?
The CAS number of methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate is 497079-68-2.
What is the molecular formula of methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate?
The molecular formula of methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate is C16H14N4O4S.
What is the molecular weight of methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate?
The molecular weight of methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate is 358.07 g/mol.
Where can I buy methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate?
You can request a quote for methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-[[(3Z)-3-(carbamothioylhydrazinylidene)-2-oxoindol-1-yl]methyl]furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.