4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline
TL;DR: 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline (CAS 743-91-9) is a chemical compound with molecular formula C20H17NO3 and molecular weight 319.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(2-hydroxynaphthalen-1-yl)methylideneamino]benzoate
Also Known As: Ethyl 4-(((2-hydroxynaphthalen-1-yl)methylene)amino)benzoate, s11633, Ethyl 4-{(E)-[(2-hydroxy-1-naphthyl)methylene]amino}benzoate, ethyl 4-[(2-oxonaphthalen-1-ylidene)methylamino]benzoate, 4-(ETHOXYCARBONYL)-N-(2-HYDROXY-1-NAPHTHYLMETHYLENE)ANILINE
| Molecular Formula | C20H17NO3 |
|---|---|
| Molecular Weight | 319.12 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.12085 |
| Heavy Atoms | 24 |
| Complexity | 442.0 |
Chemical Identifiers
| CAS Number | 743-91-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N=CC2=C(C=CC3=CC=CC=C32)O |
| InChIKey | CWWAKPGLKRKXRP-UHFFFAOYSA-N |
Product Overview
4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline (CAS 743-91-9), with molecular formula C20H17NO3 and molecular weight 319.12 g/mol. IUPAC: ethyl 4-[(2-hydroxynaphthalen-1-yl)methylideneamino]benzoate.
Chemical Property Profile of 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline
Property Insights of 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline
The XLogP value of 4.3 indicates that 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline has 1 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-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline?
The CAS number of 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline is 743-91-9.
What is the molecular formula of 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline?
The molecular formula of 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline is C20H17NO3.
What is the molecular weight of 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline?
The molecular weight of 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline is 319.12 g/mol.
Where can I buy 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline?
You can request a quote for 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(Ethoxycarbonyl)-N-(2-hydroxy-1-naphthylmethylene)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.