Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester
TL;DR: Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester (CAS 57834-33-0) is a chemical compound with molecular formula C17H18N2O2 and molecular weight 282.13684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-[(N-methylanilino)methylideneamino]benzoate
Also Known As: Ethyl 4-[[(methylphenylamino)methylene]amino]benzoate, Ethyl 4-(((methyl(phenyl)amino)methylene)amino)benzoate, Benzoic acid, 4-[[(methylphenylamino)methylene]amino]-, ethyl ester, ACN-S002301, Ethyl 4-(((methylphenylamino)methylene)amino)benzoate
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H18N2O2 |
| Molecular Weight | 282.13684 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 282.13684 Da |
| Heavy Atoms | 21 |
| Complexity | 343.0 |
| SMILES | CCOC(=O)C1=CC=C(C=C1)N=CN(C)C2=CC=CC=C2 |
| InChIKey | GNGYPJUKIKDJQT-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester
Property Insights of Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester
The XLogP value of 3.4 indicates that Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester?
The CAS number of Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester is 57834-33-0.
What is the molecular formula of Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester?
The molecular formula of Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester is C17H18N2O2.
What is the molecular weight of Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester?
The molecular weight of Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester is 282.13684 g/mol.
Where can I buy Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester?
You can request a quote for Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 4-(((methylphenylamino)methylene)amino)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.