TL;DR: Urea, 3-((3,5-dimethoxyphenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)- (CAS 136132-24-6) is a chemical compound with molecular formula C21H28N2O3 and molecular weight 356.21 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(3,5-dimethoxyphenyl)methyl]-3,3-dimethyl-1-(4-propan-2-ylphenyl)urea
Also Known As: Urea, 3-((3,5-dimethoxyphenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)-, 1-[(3,5-dimethoxyphenyl)methyl]-3,3-dimethyl-1-(4-propan-2-ylphenyl)urea, N-[(3,5-Dimethoxyphenyl)methyl]-N',N'-dimethyl-N-[4-(propan-2-yl)phenyl]urea
| Molecular Formula | C21H28N2O3 |
| Molecular Weight | 356.21 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 42.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.21 Da |
| Heavy Atoms | 26 |
| Complexity | 421.0 |
| SMILES | CC(C)C1=CC=C(C=C1)N(CC2=CC(=CC(=C2)OC)OC)C(=O)N(C)C |
| InChIKey | TWAUIVTVAYYYIM-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that Urea, 3-((3,5-dimethoxyphenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, Urea, 3-((3,5-dimethoxyphenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 3-((3,5-dimethoxyphenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Urea, 3-((3,5-dimethoxyphenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)- is 136132-24-6.
The molecular formula of Urea, 3-((3,5-dimethoxyphenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)- is C21H28N2O3.
The molecular weight of Urea, 3-((3,5-dimethoxyphenyl)methyl)-1,1-dimethyl-3-(4-propan-2-ylphenyl)- is 356.21 g/mol.
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