![methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate structure](/static/products/314/314284-18-9.png)
methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate
TL;DR: methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate (CAS 314284-18-9) is a chemical compound with molecular formula C21H17Cl2NO2S and molecular weight 417.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-benzyl-2-[(E)-(2,3-dichlorophenyl)methylideneamino]-4-methylthiophene-3-carboxylate
Also Known As: methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate, Methyl 5-benzyl-2-[(2,3-dichlorophenyl)methylideneamino]-4-methyl-thiophene-3-carboxylate, methyl 2-[(1E)-2-(2,3-dichlorophenyl)-1-azavinyl]-4-methyl-5-benzylthiophene-3 -carboxylate, methyl 5-benzyl-2-{[(E)-(2,3-dichlorophenyl)methylidene]amino}-4-methylthiophene-3-carboxylate
| Molecular Formula | C21H17Cl2NO2S |
|---|---|
| Molecular Weight | 417.04 g/mol |
| LogP | 6.49132 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.0357 |
| Heavy Atoms | 27 |
| Complexity | 996.91626 |
Chemical Identifiers
| CAS Number | 314284-18-9 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)/N=C/C2=C(C(=CC=C2)Cl)Cl)CC3=CC=CC=C3 |
Product Overview
methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate (CAS 314284-18-9), with molecular formula C21H17Cl2NO2S and molecular weight 417.04 g/mol. IUPAC: methyl 5-benzyl-2-[(E)-(2,3-dichlorophenyl)methylideneamino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate
Property Insights of methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate
The XLogP value of 6.49132 indicates that methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.66 Ų, methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate has 0 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 methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate?
The CAS number of methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate is 314284-18-9.
What is the molecular formula of methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate?
The molecular formula of methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate is C21H17Cl2NO2S.
What is the molecular weight of methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate?
The molecular weight of methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate is 417.04 g/mol.
Where can I buy methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate?
You can request a quote for methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-benzyl-2-[(2,3-dichlorobenzylidene)amino]-4-methyl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.