![propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate structure](/static/products/304/304454-79-3.png)
propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate
TL;DR: propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate (CAS 304454-79-3) is a chemical compound with molecular formula C18H19NO2S and molecular weight 313.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-[(4-methylsulfanylphenyl)methylideneamino]benzoate
Also Known As: propyl 4-{[4-(methylsulfanyl)benzylidene]amino}benzoate, propyl 4-[(4-methylsulfanylphenyl)methylideneamino]benzoate, propyl 4-[(1E)-2-(4-methylthiophenyl)-1-azavinyl]benzoate, propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate
| Molecular Formula | C18H19NO2S |
|---|---|
| Molecular Weight | 313.11 g/mol |
| LogP | 4.7259 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.11365 |
| Heavy Atoms | 22 |
| Complexity | 633.14166 |
Chemical Identifiers
| CAS Number | 304454-79-3 |
|---|---|
| SMILES | CCCOC(=O)C1=CC=C(C=C1)N=CC2=CC=C(C=C2)SC |
Product Overview
propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate (CAS 304454-79-3), with molecular formula C18H19NO2S and molecular weight 313.11 g/mol. IUPAC: propyl 4-[(4-methylsulfanylphenyl)methylideneamino]benzoate.
Chemical Property Profile of propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate
Property Insights of propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate
The XLogP value of 4.7259 indicates that propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.66 Ų, propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate has 0 hydrogen bond donor(s) and 4 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 propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate?
The CAS number of propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate is 304454-79-3.
What is the molecular formula of propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate?
The molecular formula of propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate is C18H19NO2S.
What is the molecular weight of propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate?
The molecular weight of propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate is 313.11 g/mol.
Where can I buy propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate?
You can request a quote for propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for propyl 4-({(E)-[4-(methylsulfanyl)phenyl]methylidene}amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.