![1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea structure](/static/products/4449/444931-29-7.webp)
1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea
TL;DR: 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea (CAS 444931-29-7) is a chemical compound with molecular formula C21H28ClN3O3 and molecular weight 405.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea
Also Known As: 1-(1-adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea, N-(1-adamantyl)-2-[(4-chloro-3,5-dimethylphenoxy)acetyl]hydrazinecarboxamide, N-[(N-adamantanylcarbamoyl)amino]-2-(4-chloro-3,5-dimethylphenoxy)acetamide, 2-[(4-chloro-3,5-dimethylphenoxy)acetyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)hydrazinecarboxamide
| Molecular Formula | C21H28ClN3O3 |
|---|---|
| Molecular Weight | 405.18 g/mol |
| LogP | 3.63484 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.18192 |
| Heavy Atoms | 28 |
| Complexity | 736.8114 |
Chemical Identifiers
| CAS Number | 444931-29-7 |
|---|---|
| SMILES | CC1=CC(=CC(=C1Cl)C)OCC(=O)NNC(=O)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea (CAS 444931-29-7), with molecular formula C21H28ClN3O3 and molecular weight 405.18 g/mol. IUPAC: 1-(1-adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea.
Chemical Property Profile of 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea
Property Insights of 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea
The XLogP value of 3.63484 indicates that 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea. Following Lipinski's Rule of Five, 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea has 3 hydrogen bond donor(s) and 3 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 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea?
The CAS number of 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea is 444931-29-7.
What is the molecular formula of 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea?
The molecular formula of 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea is C21H28ClN3O3.
What is the molecular weight of 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea?
The molecular weight of 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea is 405.18 g/mol.
Where can I buy 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea?
You can request a quote for 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Adamantyl)-3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.