TL;DR: Thiourea, N-phenyl-N'-tetradecyl- (CAS 111782-17-3) is a chemical compound with molecular formula C21H36N2S and molecular weight 348.25992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-phenyl-3-tetradecylthiourea
Also Known As: 1-phenyl-3-tetradecylthiourea, Thiourea, N-phenyl-N'-tetradecyl-, N-phenyl-N'-tetradecylthiourea, 3-phenyl-1-tetradecyl-thiourea, 1-phenyl-3-tetradecyl-2-thiourea
| Molecular Formula | C21H36N2S |
| Molecular Weight | 348.25992 g/mol |
| XLogP | 7.7 |
| Topological Polar Surface Area (TPSA) | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 14 |
| Exact Mass | 348.25992 Da |
| Heavy Atoms | 24 |
| Complexity | 288.0 |
| SMILES | CCCCCCCCCCCCCCNC(=S)NC1=CC=CC=C1 |
| InChIKey | VYPUTGOCHAGRIZ-UHFFFAOYSA-N |
The XLogP value of 7.7 indicates that Thiourea, N-phenyl-N'-tetradecyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.2 Ų, Thiourea, N-phenyl-N'-tetradecyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiourea, N-phenyl-N'-tetradecyl- has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Thiourea, N-phenyl-N'-tetradecyl- is 111782-17-3.
The molecular formula of Thiourea, N-phenyl-N'-tetradecyl- is C21H36N2S.
The molecular weight of Thiourea, N-phenyl-N'-tetradecyl- is 348.25992 g/mol.
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