N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea
TL;DR: N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea (CAS 343375-03-1) is a chemical compound with molecular formula C16H21N3O2S and molecular weight 319.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-cyano-4,5-dimethoxyphenyl)-3-cyclohexylthiourea
Also Known As: N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea, 3-(2-cyano-4,5-dimethoxyphenyl)-1-cyclohexylthiourea, 1-(2-cyano-4,5-dimethoxyphenyl)-3-cyclohexylthiourea, 6N-816, 1-(2-cyano-4,5-dimethoxy-phenyl)-3-cyclohexyl-thiourea
| Molecular Formula | C16H21N3O2S |
|---|---|
| Molecular Weight | 319.14 g/mol |
| LogP | 3.19458 |
| Topological Polar Surface Area | 66.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.13544 |
| Heavy Atoms | 22 |
| Complexity | 577.489 |
Chemical Identifiers
| CAS Number | 343375-03-1 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C#N)NC(=S)NC2CCCCC2)OC |
Product Overview
N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea (CAS 343375-03-1), with molecular formula C16H21N3O2S and molecular weight 319.14 g/mol. IUPAC: 1-(2-cyano-4,5-dimethoxyphenyl)-3-cyclohexylthiourea.
Chemical Property Profile of N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea
Property Insights of N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea
The XLogP value of 3.19458 indicates that N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.31 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea. Following Lipinski's Rule of Five, N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea has 2 hydrogen bond donor(s) and 4 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-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea?
The CAS number of N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea is 343375-03-1.
What is the molecular formula of N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea?
The molecular formula of N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea is C16H21N3O2S.
What is the molecular weight of N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea?
The molecular weight of N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea is 319.14 g/mol.
Where can I buy N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea?
You can request a quote for N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(2-cyano-4,5-dimethoxyphenyl)-N'-cyclohexylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.