![[1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate structure](/static/products/3280/328023-62-7.webp)
[1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate
TL;DR: [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate (CAS 328023-62-7) is a chemical compound with molecular formula C16H14BrNO2 and molecular weight 331.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(4-methylphenyl)ethylideneamino] 4-bromobenzoate
Also Known As: 1-(4-methylphenyl)ethanone O-(4-bromobenzoyl)oxime, [1-(4-methylphenyl)ethylideneamino] 4-bromobenzoate
| Molecular Formula | C16H14BrNO2 |
|---|---|
| Molecular Weight | 331.02 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 331.02078 |
| Heavy Atoms | 20 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 328023-62-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=NOC(=O)C2=CC=C(C=C2)Br)C |
| InChIKey | GSSQKTIKJHKUSY-UHFFFAOYSA-N |
Product Overview
[1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate (CAS 328023-62-7), with molecular formula C16H14BrNO2 and molecular weight 331.02 g/mol. IUPAC: [1-(4-methylphenyl)ethylideneamino] 4-bromobenzoate.
Chemical Property Profile of [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate
Property Insights of [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate
The XLogP value of 4.7 indicates that [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate 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
Frequently Asked Questions
What is the CAS number of [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate?
The CAS number of [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate is 328023-62-7.
What is the molecular formula of [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate?
The molecular formula of [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate is C16H14BrNO2.
What is the molecular weight of [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate?
The molecular weight of [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate is 331.02 g/mol.
Where can I buy [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate?
You can request a quote for [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [1-(4-Methylphenyl)ethylideneamino] 4-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.