TL;DR: 3-(3,4-Diethylphenyl)-1,1-dimethylurea (CAS 107598-64-1) is a chemical compound with molecular formula C13H20N2O and molecular weight 220.15756 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,4-diethylphenyl)-1,1-dimethylurea
Also Known As: 3-(3,4-Diethylphenyl)-1,1-dimethylurea, N'-(3,4-Diethylphenyl)-N,N-dimethylurea, 3-(3,4-diethylphenyl)-1,1-dimethyl-urea
| Molecular Formula | C13H20N2O |
| Molecular Weight | 220.15756 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.15756 Da |
| Heavy Atoms | 16 |
| Complexity | 228.0 |
| SMILES | CCC1=C(C=C(C=C1)NC(=O)N(C)C)CC |
| InChIKey | RSNJRHHLAOFTIH-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,4-Diethylphenyl)-1,1-dimethylurea. With a topological polar surface area (TPSA) of 32.3 Ų, 3-(3,4-Diethylphenyl)-1,1-dimethylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,4-Diethylphenyl)-1,1-dimethylurea has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(3,4-Diethylphenyl)-1,1-dimethylurea is 107598-64-1.
The molecular formula of 3-(3,4-Diethylphenyl)-1,1-dimethylurea is C13H20N2O.
The molecular weight of 3-(3,4-Diethylphenyl)-1,1-dimethylurea is 220.15756 g/mol.
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