1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea
TL;DR: 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea (CAS 454249-70-8) is a chemical compound with molecular formula C15H20N4S and molecular weight 288.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea
Also Known As: 1-(3,5-dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea, 3-(3,5-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)thiourea, 1-(3,5-dimethylphenyl)-3-[3-(1H-imidazol-1-yl)propyl]thiourea, [(3,5-dimethylphenyl)amino][(3-imidazolylpropyl)amino]methane-1-thione
| Molecular Formula | C15H20N4S |
|---|---|
| Molecular Weight | 288.14 g/mol |
| LogP | 2.87664 |
| Topological Polar Surface Area | 41.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.14087 |
| Heavy Atoms | 20 |
| Complexity | 543.00745 |
Chemical Identifiers
| CAS Number | 454249-70-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC(=S)NCCCN2C=CN=C2)C |
Product Overview
1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea (CAS 454249-70-8), with molecular formula C15H20N4S and molecular weight 288.14 g/mol. IUPAC: 1-(3,5-dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea.
Chemical Property Profile of 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea
Property Insights of 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea
The XLogP value of 2.87664 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea. With a topological polar surface area (TPSA) of 41.88 Ų, 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)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 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea?
The CAS number of 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea is 454249-70-8.
What is the molecular formula of 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea?
The molecular formula of 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea is C15H20N4S.
What is the molecular weight of 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea?
The molecular weight of 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea is 288.14 g/mol.
Where can I buy 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea?
You can request a quote for 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-Dimethylphenyl)-3-(3-imidazol-1-ylpropyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.