ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene)
TL;DR: ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene) (CAS 40398-66-1) is a chemical compound with molecular formula C14H19N5O2S and molecular weight 321.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-[2-(methylcarbamothioylhydrazinylidene)propylidene]hydrazinyl]benzoate
Also Known As: ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene), ethyl 4-[2-[2-(methylcarbamothioylhydrazinylidene)propylidene]hydrazinyl]benzoate
| Molecular Formula | C14H19N5O2S |
|---|---|
| Molecular Weight | 321.13 g/mol |
| LogP | 1.7308 |
| Topological Polar Surface Area | 87.11 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 321.12595 |
| Heavy Atoms | 22 |
| Complexity | 569.1008 |
Chemical Identifiers
| CAS Number | 40398-66-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NN=CC(=NNC(=S)NC)C |
Product Overview
ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene) (CAS 40398-66-1), with molecular formula C14H19N5O2S and molecular weight 321.13 g/mol. IUPAC: ethyl 4-[2-[2-(methylcarbamothioylhydrazinylidene)propylidene]hydrazinyl]benzoate.
Chemical Property Profile of ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene)
Property Insights of ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene)
The XLogP value of 1.7308 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene). The TPSA of 87.11 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene). Following Lipinski's Rule of Five, ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene) has 3 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 ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene)?
The CAS number of ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene) is 40398-66-1.
What is the molecular formula of ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene)?
The molecular formula of ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene) is C14H19N5O2S.
What is the molecular weight of ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene)?
The molecular weight of ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene) is 321.13 g/mol.
Where can I buy ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene)?
You can request a quote for ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene)?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-[(2Z)-2-[(2Z)-2-(methylcarbamothioylhydrazinylidene) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.