4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯
TL;DR: 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯 (CAS 16571-39-4) is a chemical compound with molecular formula C21H17NO3 and molecular weight 331.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯
[4-[(4-methoxyphenyl)methylideneamino]phenyl] benzoate
Also Known As: [4-[(4-methoxyphenyl)methylideneamino]phenyl] benzoate|Phenol, 4-(((4-methoxyphenyl)methylene)amino)-, 1-benzoate|Phenol, 4-(((4-methoxyphenyl)methylene)amino)-, benzoate (ester)|Phenol, 4-[[(4-methoxyphenyl)methylene]amino]-, benzoate (ester)|Benzoic acid 4-[[(4-methoxyphenyl)methylene]amino]phenyl ester|4-{[(4-METHOXYPHENYL)METHYLIDENE]AMINO}PHENYL BENZOATE|Phenol, 4-[[(4-methoxyphenyl)methylene]amino]-, 1-benzoate|Phenol,4-(((4-methoxyphenyl)methylene)amino)-,benzoate (ester)|RefChem:172791|DTXCID0035322|ZXGYKJZWIKJRHR-UHFFFAOYSA-N
| Molecular Formula | C21H17NO3 |
|---|---|
| Molecular Weight | 331.12 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.12085 |
| Heavy Atoms | 25 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 16571-39-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)OC(=O)C3=CC=CC=C3 |
| InChIKey | ZXGYKJZWIKJRHR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯 (CAS 16571-39-4), with molecular formula C21H17NO3 and molecular weight 331.12 g/mol. IUPAC: [4-[(4-methoxyphenyl)methylideneamino]phenyl] benzoate.
Chemical Property Profile of 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯
Property Insights of 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯
The XLogP value of 4.9 indicates that 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯 has 0 hydrogen bond donor(s) and 4 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 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯?
The CAS number of 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯 is 16571-39-4.
What is the molecular formula of 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯?
The molecular formula of 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯 is C21H17NO3.
What is the molecular weight of 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯?
The molecular weight of 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯 is 331.12 g/mol.
Where can I buy 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯?
You can request a quote for 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 4-(((4-甲氧基苯基)亚甲基)氨基)苯酚 1-苯甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.