![4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone structure](/static/products/303/303199-99-7.png)
4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone
TL;DR: 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone (CAS 303199-99-7) is a chemical compound with molecular formula C18H17Cl2N3OS and molecular weight 393.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-3-prop-2-enylthiourea
Also Known As: 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone, AN-648/40683058, (2E)-2-{4-[(2,4-dichlorobenzyl)oxy]benzylidene}-N-(prop-2-en-1-yl)hydrazinecarbothioamide, 1-[(E)-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-3-prop-2-enylthiourea
| Molecular Formula | C18H17Cl2N3OS |
|---|---|
| Molecular Weight | 393.05 g/mol |
| LogP | 4.5564 |
| Topological Polar Surface Area | 45.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 393.04694 |
| Heavy Atoms | 25 |
| Complexity | 763.41656 |
Chemical Identifiers
| CAS Number | 303199-99-7 |
|---|---|
| SMILES | C=CCNC(=S)N/N=C/C1=CC=C(C=C1)OCC2=C(C=C(C=C2)Cl)Cl |
Product Overview
4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone (CAS 303199-99-7), with molecular formula C18H17Cl2N3OS and molecular weight 393.05 g/mol. IUPAC: 1-[(E)-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-3-prop-2-enylthiourea.
Chemical Property Profile of 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone
Property Insights of 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone
The XLogP value of 4.5564 indicates that 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.65 Ų, 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone has 2 hydrogen bond donor(s) and 3 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 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone?
The CAS number of 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone is 303199-99-7.
What is the molecular formula of 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone?
The molecular formula of 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone is C18H17Cl2N3OS.
What is the molecular weight of 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone?
The molecular weight of 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone is 393.05 g/mol.
Where can I buy 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone?
You can request a quote for 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2,4-dichlorobenzyl)oxy]benzaldehyde N-allylthiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.