![1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea structure](/static/products/5213/521327-74-2.webp)
1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea
TL;DR: 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea (CAS 521327-74-2) is a chemical compound with molecular formula C20H27FN2S and molecular weight 346.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(1-adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea
Also Known As: 1-[1-(1-adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea, N-[1-(1-adamantyl)ethyl]-N'-(4-fluorobenzyl)thiourea, 1-(4-fluorobenzyl)-3-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]thiourea, [(adamantanylethyl)amino]{[(4-fluorophenyl)methyl]amino}methane-1-thione
| Molecular Formula | C20H27FN2S |
|---|---|
| Molecular Weight | 346.19 g/mol |
| LogP | 4.3947 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.1879 |
| Heavy Atoms | 24 |
| Complexity | 577.2856 |
Chemical Identifiers
| CAS Number | 521327-74-2 |
|---|---|
| SMILES | CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NCC4=CC=C(C=C4)F |
Product Overview
1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea (CAS 521327-74-2), with molecular formula C20H27FN2S and molecular weight 346.19 g/mol. IUPAC: 1-[1-(1-adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea.
Chemical Property Profile of 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea
Property Insights of 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea
The XLogP value of 4.3947 indicates that 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea 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-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea?
The CAS number of 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea is 521327-74-2.
What is the molecular formula of 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea?
The molecular formula of 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea is C20H27FN2S.
What is the molecular weight of 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea?
The molecular weight of 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea is 346.19 g/mol.
Where can I buy 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea?
You can request a quote for 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-(1-Adamantyl)ethyl]-3-[(4-fluorophenyl)methyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.