N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester
TL;DR: N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester (CAS 55911-96-1) is a chemical compound with molecular formula C13H18N2O5 and molecular weight 282.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]carbamate
Also Known As: ethyl 2-(3,4,5-trimethoxybenzylidene)hydrazinecarboxylate, N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester, ethyl (2E)-2-(3,4,5-trimethoxybenzylidene)hydrazinecarboxylate, ethyl N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]carbamate, (E)-Ethyl N'-(3,4,5-trimethoxybenzylidene)hydrazinecarboxylate
| Molecular Formula | C13H18N2O5 |
|---|---|
| Molecular Weight | 282.12 g/mol |
| LogP | 1.7924 |
| Topological Polar Surface Area | 78.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 282.12158 |
| Heavy Atoms | 20 |
| Complexity | 462.64502 |
Chemical Identifiers
| CAS Number | 55911-96-1 |
|---|---|
| SMILES | CCOC(=O)N/N=C/C1=CC(=C(C(=C1)OC)OC)OC |
Product Overview
N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester (CAS 55911-96-1), with molecular formula C13H18N2O5 and molecular weight 282.12 g/mol. IUPAC: ethyl N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]carbamate.
Chemical Property Profile of N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester
Property Insights of N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester
The XLogP value of 1.7924 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester. The TPSA of 78.38 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester. Following Lipinski's Rule of Five, N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester has 1 hydrogen bond donor(s) and 6 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 N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester?
The CAS number of N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester is 55911-96-1.
What is the molecular formula of N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester?
The molecular formula of N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester is C13H18N2O5.
What is the molecular weight of N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester?
The molecular weight of N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester is 282.12 g/mol.
Where can I buy N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester?
You can request a quote for N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for N'-(3,4,5-Trimethoxybenzylidene)carbazic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.