1-Benzyl-3-cyclohexylthiourea
TL;DR: 1-Benzyl-3-cyclohexylthiourea (CAS 79381-29-6) is a chemical compound with molecular formula C14H20N2S and molecular weight 248.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-cyclohexylthiourea
Also Known As: 1-benzyl-3-cyclohexylthiourea, 3-benzyl-1-cyclohexylthiourea, 1-Benzyl-3-cyclohexyl-thiourea, BAS 00581290, N'-Benzyl-N-cyclohexylcarbamimidothioic acid
| Molecular Formula | C14H20N2S |
|---|---|
| Molecular Weight | 248.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.13472 |
| Heavy Atoms | 17 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 79381-29-6 |
|---|---|
| SMILES | C1CCC(CC1)NC(=S)NCC2=CC=CC=C2 |
| InChIKey | WUJPBZFYSNBQRH-UHFFFAOYSA-N |
Product Overview
1-Benzyl-3-cyclohexylthiourea (CAS 79381-29-6), with molecular formula C14H20N2S and molecular weight 248.13 g/mol. IUPAC: 1-benzyl-3-cyclohexylthiourea.
Chemical Property Profile of 1-Benzyl-3-cyclohexylthiourea
Property Insights of 1-Benzyl-3-cyclohexylthiourea
The XLogP value of 3.3 indicates that 1-Benzyl-3-cyclohexylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.2 Ų, 1-Benzyl-3-cyclohexylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-3-cyclohexylthiourea 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-Benzyl-3-cyclohexylthiourea?
The CAS number of 1-Benzyl-3-cyclohexylthiourea is 79381-29-6.
What is the molecular formula of 1-Benzyl-3-cyclohexylthiourea?
The molecular formula of 1-Benzyl-3-cyclohexylthiourea is C14H20N2S.
What is the molecular weight of 1-Benzyl-3-cyclohexylthiourea?
The molecular weight of 1-Benzyl-3-cyclohexylthiourea is 248.13 g/mol.
Where can I buy 1-Benzyl-3-cyclohexylthiourea?
You can request a quote for 1-Benzyl-3-cyclohexylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3-cyclohexylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3-cyclohexylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.