N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea
TL;DR: N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea (CAS 680213-57-4) is a chemical compound with molecular formula C10H13Cl2N3O and molecular weight 261.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-3-(2,6-dichloro-4-pyridinyl)urea
Also Known As: N- -N'- urea, N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea, 1-tert-butyl-3-(2,6-dichloropyridin-4-yl)urea, 3-tert-butyl-1-(2,6-dichloropyridin-4-yl)urea, N-(TERT-BUTYL)-N'-(2,6-DICHLORO-PYRIDIN-4-YL)UREA
| Molecular Formula | C10H13Cl2N3O |
|---|---|
| Molecular Weight | 261.04 g/mol |
| LogP | 3.3084 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.04358 |
| Heavy Atoms | 16 |
| Complexity | 381.2909 |
Chemical Identifiers
| CAS Number | 680213-57-4 |
|---|---|
| SMILES | CC(C)(C)NC(=O)NC1=CC(=NC(=C1)Cl)Cl |
Product Overview
N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea (CAS 680213-57-4), with molecular formula C10H13Cl2N3O and molecular weight 261.04 g/mol. IUPAC: 1-tert-butyl-3-(2,6-dichloro-4-pyridinyl)urea.
Chemical Property Profile of N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea
Property Insights of N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea
The XLogP value of 3.3084 indicates that N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea has 2 hydrogen bond donor(s) and 2 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-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea?
The CAS number of N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea is 680213-57-4.
What is the molecular formula of N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea?
The molecular formula of N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea is C10H13Cl2N3O.
What is the molecular weight of N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea?
The molecular weight of N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea is 261.04 g/mol.
Where can I buy N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea?
You can request a quote for N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-(tert-Butyl)-N'-(2,6-dichloro-4-pyridyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.