![(2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide structure](/static/products/354/354535-20-9.png)
(2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide
TL;DR: (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide (CAS 354535-20-9) is a chemical compound with molecular formula C21H26ClN3O3S and molecular weight 435.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-[4-[2-(4-butan-2-ylphenoxy)ethoxy]-3-chloro-5-methoxyphenyl]methylideneamino]thiourea
Also Known As: (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide, (E)-2-(4-(2-(4-(sec-butyl)phenoxy)ethoxy)-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide, {[(1E)-2-(3-chloro-5-methoxy-4-{2-[4-(methylpropyl)phenoxy]ethoxy}phenyl)-1-az avinyl]amino}aminomethane-1-thione
| Molecular Formula | C21H26ClN3O3S |
|---|---|
| Molecular Weight | 435.14 g/mol |
| LogP | 4.487 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 435.13834 |
| Heavy Atoms | 29 |
| Complexity | 843.8101 |
Chemical Identifiers
| CAS Number | 354535-20-9 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Cl)/C=N/NC(=S)N)OC |
Product Overview
(2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide (CAS 354535-20-9), with molecular formula C21H26ClN3O3S and molecular weight 435.14 g/mol. IUPAC: [(E)-[4-[2-(4-butan-2-ylphenoxy)ethoxy]-3-chloro-5-methoxyphenyl]methylideneamino]thiourea.
Chemical Property Profile of (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide
Property Insights of (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide
The XLogP value of 4.487 indicates that (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide. Following Lipinski's Rule of Five, (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide has 2 hydrogen bond donor(s) and 5 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 (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide?
The CAS number of (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide is 354535-20-9.
What is the molecular formula of (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide?
The molecular formula of (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide is C21H26ClN3O3S.
What is the molecular weight of (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide?
The molecular weight of (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide is 435.14 g/mol.
Where can I buy (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide?
You can request a quote for (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.