2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol
TL;DR: 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol (CAS 2664-49-5) is a chemical compound with molecular formula C16H15NO4 and molecular weight 285.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol
Also Known As: 2-(1,3-benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol, 2-{[(e)-1,3-benzodioxol-5-ylmethylidene]amino}-5-ethoxyphenol, 5-ethoxy-2-{[(e)-(3-hydroxyphenyl)methylidene]amino}phenol, Phenol,2-[(1,3-benzodioxol-5-ylmethylene)amino]-5-ethoxy-, 2-{(E)-[(2H-1,3-Benzodioxol-5-yl)methylidene]amino}-5-ethoxyphenol
| Molecular Formula | C16H15NO4 |
|---|---|
| Molecular Weight | 285.10 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.1001 |
| Heavy Atoms | 21 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 2664-49-5 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)N=CC2=CC3=C(C=C2)OCO3)O |
| InChIKey | AHXGAMCZONKGBI-UHFFFAOYSA-N |
Product Overview
2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol (CAS 2664-49-5), with molecular formula C16H15NO4 and molecular weight 285.10 g/mol. IUPAC: 2-(1,3-benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol.
Chemical Property Profile of 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol
Property Insights of 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol
The XLogP value of 3.0 indicates that 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol. Following Lipinski's Rule of Five, 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol has 1 hydrogen bond donor(s) and 5 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 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol?
The CAS number of 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol is 2664-49-5.
What is the molecular formula of 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol?
The molecular formula of 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol is C16H15NO4.
What is the molecular weight of 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol?
The molecular weight of 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol is 285.10 g/mol.
Where can I buy 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol?
You can request a quote for 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Benzodioxol-5-ylmethylideneamino)-5-ethoxyphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.