![1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea structure](/static/products/7276/727673-45-2.webp)
1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea
TL;DR: 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea (CAS 727673-45-2) is a chemical compound with molecular formula C21H30N2O and molecular weight 326.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea
Also Known As: N-1-adamantyl-N'-(4-isopropylbenzyl)urea, 1-(1-adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea, N-(1-ADAMANTYL)-N'-(4-ISOPROPYLBENZYL)UREA, A3764/0159649, 1-[4-(propan-2-yl)benzyl]-3-tricyclo[3.3.1.1~3,7~]dec-1-ylurea
| Molecular Formula | C21H30N2O |
|---|---|
| Molecular Weight | 326.24 g/mol |
| LogP | 4.578 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.2358 |
| Heavy Atoms | 24 |
| Complexity | 569.4855 |
Chemical Identifiers
| CAS Number | 727673-45-2 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)CNC(=O)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea (CAS 727673-45-2), with molecular formula C21H30N2O and molecular weight 326.24 g/mol. IUPAC: 1-(1-adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea.
Chemical Property Profile of 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea
Property Insights of 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea
The XLogP value of 4.578 indicates that 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea has 2 hydrogen bond donor(s) and 1 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-[(4-propan-2-ylphenyl)methyl]urea?
The CAS number of 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea is 727673-45-2.
What is the molecular formula of 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea?
The molecular formula of 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea is C21H30N2O.
What is the molecular weight of 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea?
The molecular weight of 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea is 326.24 g/mol.
Where can I buy 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea?
You can request a quote for 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]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-[(4-propan-2-ylphenyl)methyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.