N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea
TL;DR: N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea (CAS 593240-57-4) is a chemical compound with molecular formula C16H26N2OS and molecular weight 294.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-adamantylcarbamothioyl)-2,2-dimethylpropanamide
Also Known As: N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea, N-(2-adamantylcarbamothioyl)-2,2-dimethylpropanamide, AH-487/41973727, N-(2-Adamantyl)-N/'-(2,2-dimethylpropanoyl)thiourea, 2,2-dimethyl-N-(tricyclo[3.3.1.1~3,7~]dec-2-ylcarbamothioyl)propanamide
| Molecular Formula | C16H26N2OS |
|---|---|
| Molecular Weight | 294.18 g/mol |
| LogP | 2.8479 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 294.17657 |
| Heavy Atoms | 20 |
| Complexity | 398.68304 |
Chemical Identifiers
| CAS Number | 593240-57-4 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC(=S)NC1C2CC3CC(C2)CC1C3 |
Product Overview
N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea (CAS 593240-57-4), with molecular formula C16H26N2OS and molecular weight 294.18 g/mol. IUPAC: N-(2-adamantylcarbamothioyl)-2,2-dimethylpropanamide.
Chemical Property Profile of N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea
Property Insights of N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea
The XLogP value of 2.8479 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea. With a topological polar surface area (TPSA) of 41.13 Ų, N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)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-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea?
The CAS number of N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea is 593240-57-4.
What is the molecular formula of N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea?
The molecular formula of N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea is C16H26N2OS.
What is the molecular weight of N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea?
The molecular weight of N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea is 294.18 g/mol.
Where can I buy N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea?
You can request a quote for N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(2-adamantyl)-N'-(2,2-dimethylpropanoyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.