TL;DR: 1-(4-Ethoxyphenyl)-3-(2-methylphenyl)thiourea (CAS 1227-19-6) is a chemical compound with molecular formula C16H18N2OS and molecular weight 286.11398 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-ethoxyphenyl)-3-(2-methylphenyl)thiourea
Also Known As: 1-(4-ethoxyphenyl)-3-(2-methylphenyl)thiourea
| Molecular Formula | C16H18N2OS |
| Molecular Weight | 286.11398 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 65.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.11398 Da |
| Heavy Atoms | 20 |
| Complexity | 303.0 |
| SMILES | CCOC1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2C |
| InChIKey | VHQAFAABUXXMHZ-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 1-(4-Ethoxyphenyl)-3-(2-methylphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Ethoxyphenyl)-3-(2-methylphenyl)thiourea. Following Lipinski's Rule of Five, 1-(4-Ethoxyphenyl)-3-(2-methylphenyl)thiourea has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(4-Ethoxyphenyl)-3-(2-methylphenyl)thiourea is 1227-19-6.
The molecular formula of 1-(4-Ethoxyphenyl)-3-(2-methylphenyl)thiourea is C16H18N2OS.
The molecular weight of 1-(4-Ethoxyphenyl)-3-(2-methylphenyl)thiourea is 286.11398 g/mol.
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