4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone
TL;DR: 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone (CAS 340223-51-0) is a chemical compound with molecular formula C22H20ClN3O2S and molecular weight 425.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]-3-phenylthiourea
Also Known As: 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone, 4-[(4-chlorobenzyl)oxy]-3-methoxybenzaldehyde N-phenylthiosemicarbazone, 3-[[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methylideneamino]-1-phenyl-thiourea, 649-647-6, RefChem:509375
| Molecular Formula | C22H20ClN3O2S |
|---|---|
| Molecular Weight | 425.10 g/mol |
| LogP | 5.2481 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 425.09647 |
| Heavy Atoms | 29 |
| Complexity | 979.10736 |
Chemical Identifiers
| CAS Number | 340223-51-0 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=N/NC(=S)NC2=CC=CC=C2)OCC3=CC=C(C=C3)Cl |
Product Overview
4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone (CAS 340223-51-0), with molecular formula C22H20ClN3O2S and molecular weight 425.10 g/mol. IUPAC: 1-[(E)-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]-3-phenylthiourea.
Chemical Property Profile of 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone
Property Insights of 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone
The XLogP value of 5.2481 indicates that 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone?
The CAS number of 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone is 340223-51-0.
What is the molecular formula of 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone?
The molecular formula of 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone is C22H20ClN3O2S.
What is the molecular weight of 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone?
The molecular weight of 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone is 425.10 g/mol.
Where can I buy 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone?
You can request a quote for 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde N-phenylthiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.