N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea
TL;DR: N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea (CAS 519150-11-9) is a chemical compound with molecular formula C19H23FN2OS and molecular weight 346.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-fluorophenyl)methylcarbamothioyl]adamantane-1-carboxamide
Also Known As: N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea, AF-399/41488194, N-[(4-fluorophenyl)methylcarbamothioyl]adamantane-1-carboxamide
| Molecular Formula | C19H23FN2OS |
|---|---|
| Molecular Weight | 346.15 g/mol |
| LogP | 3.5328 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.15152 |
| Heavy Atoms | 24 |
| Complexity | 622.55133 |
Chemical Identifiers
| CAS Number | 519150-11-9 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NCC4=CC=C(C=C4)F |
Product Overview
N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea (CAS 519150-11-9), with molecular formula C19H23FN2OS and molecular weight 346.15 g/mol. IUPAC: N-[(4-fluorophenyl)methylcarbamothioyl]adamantane-1-carboxamide.
Chemical Property Profile of N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea
Property Insights of N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea
The XLogP value of 3.5328 indicates that N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea 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-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea?
The CAS number of N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea is 519150-11-9.
What is the molecular formula of N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea?
The molecular formula of N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea is C19H23FN2OS.
What is the molecular weight of N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea?
The molecular weight of N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea is 346.15 g/mol.
Where can I buy N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea?
You can request a quote for N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(1-adamantylcarbonyl)-N'-(4-fluorobenzyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.