TL;DR: Urea, 1-(2-bromoethyl)-3-(2-ethoxy-1-naphthyl)- (CAS 102434-23-1) is a chemical compound with molecular formula C15H17BrN2O2 and molecular weight 336.04733 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-bromoethyl)-3-(2-ethoxynaphthalen-1-yl)urea
Also Known As: Urea, 1-(2-bromoethyl)-3-(2-ethoxy-1-naphthyl)-, 1-(2-Bromoethyl)-3-(2-ethoxy-1-naphthyl)urea, 1-(2-bromoethyl)-3-(2-ethoxynaphthalen-1-yl)urea, Urea,3-(2-bromoethyl)-1-(3-bromo-2-naphthyl), Urea,N-(2-bromoethyl)-N'-(2-ethoxy-1-naphthalenyl)-
| Molecular Formula | C15H17BrN2O2 |
| Molecular Weight | 336.04733 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.04733 Da |
| Heavy Atoms | 20 |
| Complexity | 314.0 |
| SMILES | CCOC1=C(C2=CC=CC=C2C=C1)NC(=O)NCCBr |
| InChIKey | UHRBGPMASDLVQW-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that Urea, 1-(2-bromoethyl)-3-(2-ethoxy-1-naphthyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.4 Ų, Urea, 1-(2-bromoethyl)-3-(2-ethoxy-1-naphthyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-(2-bromoethyl)-3-(2-ethoxy-1-naphthyl)- 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 Urea, 1-(2-bromoethyl)-3-(2-ethoxy-1-naphthyl)- is 102434-23-1.
The molecular formula of Urea, 1-(2-bromoethyl)-3-(2-ethoxy-1-naphthyl)- is C15H17BrN2O2.
The molecular weight of Urea, 1-(2-bromoethyl)-3-(2-ethoxy-1-naphthyl)- is 336.04733 g/mol.
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