![methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate structure](/static/products/131/131528-54-6.webp)
methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate
TL;DR: methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate (CAS 131528-54-6) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.11575 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[(3,4-dimethoxyphenyl)methylideneamino]benzoate
Also Known As: (E)-methyl 4-((3,4-dimethoxybenzylidene)amino)benzoate, methyl 4-[(3,4-dimethoxyphenyl)methylideneamino]benzoate, methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate
Technical Specifications
| Molecular Formula | C17H17NO4 |
| Molecular Weight | 299.11575 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 57.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 299.11575 Da |
| Heavy Atoms | 22 |
| Complexity | 377.0 |
| SMILES | COC1=C(C=C(C=C1)C=NC2=CC=C(C=C2)C(=O)OC)OC |
| InChIKey | GOUWZMJLUXAHAT-UHFFFAOYSA-N |
Chemical Property Profile of methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate
Property Insights of methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate
The XLogP value of 3.0 indicates that methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.1 Ų, methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate?
The CAS number of methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate is 131528-54-6.
What is the molecular formula of methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate?
The molecular formula of methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate is C17H17NO4.
What is the molecular weight of methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate?
The molecular weight of methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate is 299.11575 g/mol.
Where can I buy methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate?
You can request a quote for methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate?
Yes, CoreyChem provides custom synthesis services for methyl 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.