1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea
TL;DR: 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea (CAS 372507-41-0) is a chemical compound with molecular formula C21H30N2O3 and molecular weight 358.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea
Also Known As: 1-(1-adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea, AO-080/40204594, Urea, 1-(adamantan-1-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-, N-1-adamantyl-N'-[2-(3,4-dimethoxyphenyl)ethyl]urea, N-(1-adamantyl)-N'-[2-(3,4-dimethoxyphenyl)ethyl]urea
| Molecular Formula | C21H30N2O3 |
|---|---|
| Molecular Weight | 358.23 g/mol |
| LogP | 3.5143 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.22565 |
| Heavy Atoms | 26 |
| Complexity | 637.93585 |
Chemical Identifiers
| CAS Number | 372507-41-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)NC23CC4CC(C2)CC(C4)C3)OC |
Product Overview
1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea (CAS 372507-41-0), with molecular formula C21H30N2O3 and molecular weight 358.23 g/mol. IUPAC: 1-(1-adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea.
Chemical Property Profile of 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea
Property Insights of 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea
The XLogP value of 3.5143 indicates that 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea has 2 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-(3,4-dimethoxyphenyl)ethyl]urea?
The CAS number of 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea is 372507-41-0.
What is the molecular formula of 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea?
The molecular formula of 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea is C21H30N2O3.
What is the molecular weight of 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea?
The molecular weight of 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea is 358.23 g/mol.
Where can I buy 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea?
You can request a quote for 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]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-(3,4-dimethoxyphenyl)ethyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Adamantyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.