ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate
TL;DR: ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate (CAS 21271-66-9) is a chemical compound with molecular formula C16H22N6O4S and molecular weight 394.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridinyl]carbamate
Also Known As: 4-[2-(2(3H)-benzoxazolon-3-yl)ethoxy]benzaldehyde, Benzaldehyde,4-[2-(2-oxo-3(2H)-benzoxazolyl)ethoxy], ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate, ethyl(5,6-diamino-4-{[2-(4-sulfamoylphenyl)ethyl]amino}pyridin-2-yl)carbamate, ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]pyridin-2-yl]carbamate
| Molecular Formula | C16H22N6O4S |
|---|---|
| Molecular Weight | 394.14 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 184.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 394.14233 |
| Heavy Atoms | 27 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 21271-66-9 |
|---|---|
| SMILES | CCOC(=O)NC1=NC(=C(C(=C1)NCCC2=CC=C(C=C2)S(=O)(=O)N)N)N |
| InChIKey | LLNJIXHAGCNTAZ-UHFFFAOYSA-N |
Product Overview
ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate (CAS 21271-66-9), with molecular formula C16H22N6O4S and molecular weight 394.14 g/mol. IUPAC: ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridinyl]carbamate.
Chemical Property Profile of ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate
Property Insights of ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate. The TPSA of 184.0 Ų indicates high polarity, suggesting ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate has 5 hydrogen bond donor(s) and 9 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 ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate?
The CAS number of ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate is 21271-66-9.
What is the molecular formula of ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate?
The molecular formula of ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate is C16H22N6O4S.
What is the molecular weight of ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate?
The molecular weight of ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate is 394.14 g/mol.
Where can I buy ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate?
You can request a quote for ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[5,6-diamino-4-[2-(4-sulfamoylphenyl)ethylamino]-2-pyridyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.