N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea
TL;DR: N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea (CAS 297149-97-4) is a chemical compound with molecular formula C15H19N3S and molecular weight 273.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-cyano-4-methylphenyl)-3-cyclohexylthiourea
Also Known As: N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea, 3-(3-cyano-4-methylphenyl)-1-cyclohexylthiourea, 1-(3-cyano-4-methylphenyl)-3-cyclohexylthiourea, AA-768/33248062, 1-(3-cyano-4-methyl-phenyl)-3-cyclohexyl-thiourea
| Molecular Formula | C15H19N3S |
|---|---|
| Molecular Weight | 273.13 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.12997 |
| Heavy Atoms | 19 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 297149-97-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=S)NC2CCCCC2)C#N |
| InChIKey | YMSKUFBVUJRUMY-UHFFFAOYSA-N |
Product Overview
N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea (CAS 297149-97-4), with molecular formula C15H19N3S and molecular weight 273.13 g/mol. IUPAC: 1-(3-cyano-4-methylphenyl)-3-cyclohexylthiourea.
Chemical Property Profile of N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea
Property Insights of N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea
The XLogP value of 3.4 indicates that N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea. Following Lipinski's Rule of Five, N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea 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-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea?
The CAS number of N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea is 297149-97-4.
What is the molecular formula of N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea?
The molecular formula of N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea is C15H19N3S.
What is the molecular weight of N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea?
The molecular weight of N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea is 273.13 g/mol.
Where can I buy N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea?
You can request a quote for N-(3-cyano-4-methylphenyl)-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-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-4-methylphenyl)-N'-cyclohexylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.