N-(2,2-diethoxyethyl)-N'-isonicotinoylurea
TL;DR: N-(2,2-diethoxyethyl)-N'-isonicotinoylurea (CAS 240799-41-1) is a chemical compound with molecular formula C13H19N3O4 and molecular weight 281.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,2-diethoxyethylcarbamoyl)pyridine-4-carboxamide
Also Known As: N-(2,2-diethoxyethyl)-N'-isonicotinoylurea, 3-(2,2-diethoxyethyl)-1-(pyridine-4-carbonyl)urea, N-(2,2-diethoxyethylcarbamoyl)pyridine-4-carboxamide, 10B-052
| Molecular Formula | C13H19N3O4 |
|---|---|
| Molecular Weight | 281.14 g/mol |
| LogP | 0.9201 |
| Topological Polar Surface Area | 89.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 281.13754 |
| Heavy Atoms | 20 |
| Complexity | 418.88425 |
Chemical Identifiers
| CAS Number | 240799-41-1 |
|---|---|
| SMILES | CCOC(CNC(=O)NC(=O)C1=CC=NC=C1)OCC |
Product Overview
N-(2,2-diethoxyethyl)-N'-isonicotinoylurea (CAS 240799-41-1), with molecular formula C13H19N3O4 and molecular weight 281.14 g/mol. IUPAC: N-(2,2-diethoxyethylcarbamoyl)pyridine-4-carboxamide.
Chemical Property Profile of N-(2,2-diethoxyethyl)-N'-isonicotinoylurea
Property Insights of N-(2,2-diethoxyethyl)-N'-isonicotinoylurea
The XLogP value of 0.9201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,2-diethoxyethyl)-N'-isonicotinoylurea. The TPSA of 89.55 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,2-diethoxyethyl)-N'-isonicotinoylurea. Following Lipinski's Rule of Five, N-(2,2-diethoxyethyl)-N'-isonicotinoylurea has 2 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 N-(2,2-diethoxyethyl)-N'-isonicotinoylurea?
The CAS number of N-(2,2-diethoxyethyl)-N'-isonicotinoylurea is 240799-41-1.
What is the molecular formula of N-(2,2-diethoxyethyl)-N'-isonicotinoylurea?
The molecular formula of N-(2,2-diethoxyethyl)-N'-isonicotinoylurea is C13H19N3O4.
What is the molecular weight of N-(2,2-diethoxyethyl)-N'-isonicotinoylurea?
The molecular weight of N-(2,2-diethoxyethyl)-N'-isonicotinoylurea is 281.14 g/mol.
Where can I buy N-(2,2-diethoxyethyl)-N'-isonicotinoylurea?
You can request a quote for N-(2,2-diethoxyethyl)-N'-isonicotinoylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,2-diethoxyethyl)-N'-isonicotinoylurea?
Yes, KEHONG BIO provides custom synthesis services for N-(2,2-diethoxyethyl)-N'-isonicotinoylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.