N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea
TL;DR: N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea (CAS 6281-69-2) is a chemical compound with molecular formula C17H20N2OS and molecular weight 300.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methyl-4-oxopentan-2-yl)-3-naphthalen-1-ylthiourea
Also Known As: N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea, 1-(2-methyl-4-oxopentan-2-yl)-3-naphthalen-1-ylthiourea, N-(2-Methyl-4-oxopentan-2-yl)-N'-(naphthalen-1-yl)thiourea
| Molecular Formula | C17H20N2OS |
|---|---|
| Molecular Weight | 300.13 g/mol |
| LogP | 3.8839 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.12964 |
| Heavy Atoms | 21 |
| Complexity | 674.0494 |
Chemical Identifiers
| CAS Number | 6281-69-2 |
|---|---|
| SMILES | CC(=O)CC(C)(C)NC(=S)NC1=CC=CC2=CC=CC=C21 |
Product Overview
N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea (CAS 6281-69-2), with molecular formula C17H20N2OS and molecular weight 300.13 g/mol. IUPAC: 1-(2-methyl-4-oxopentan-2-yl)-3-naphthalen-1-ylthiourea.
Chemical Property Profile of N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea
Property Insights of N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea
The XLogP value of 3.8839 indicates that N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea 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-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea 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-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea?
The CAS number of N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea is 6281-69-2.
What is the molecular formula of N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea?
The molecular formula of N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea is C17H20N2OS.
What is the molecular weight of N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea?
The molecular weight of N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea is 300.13 g/mol.
Where can I buy N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea?
You can request a quote for N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Methyl-4-oxopentan-2-yl)-N'-naphthalen-1-ylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.