TL;DR: 1-(2-Iodoethyl)-3-(4-methylphenyl)urea (CAS 151928-40-4) is a chemical compound with molecular formula C10H13IN2O and molecular weight 304.00726 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-iodoethyl)-3-(4-methylphenyl)urea
Also Known As: 1-(2-iodoethyl)-3-(4-methylphenyl)urea, KST-1B0617, N-(2-Iodoethyl)-N'-(4-methylphenyl)urea, Urea,n-(2-iodoethyl)-n-(4-methylphenyl)-, Urea,N-(2-iodoethyl)-N'-(4-methylphenyl)-
| Molecular Formula | C10H13IN2O |
| Molecular Weight | 304.00726 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.00726 Da |
| Heavy Atoms | 14 |
| Complexity | 179.0 |
| SMILES | CC1=CC=C(C=C1)NC(=O)NCCI |
| InChIKey | AIZVQULRTJJXPC-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Iodoethyl)-3-(4-methylphenyl)urea. With a topological polar surface area (TPSA) of 41.1 Ų, 1-(2-Iodoethyl)-3-(4-methylphenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Iodoethyl)-3-(4-methylphenyl)urea has 2 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 1-(2-Iodoethyl)-3-(4-methylphenyl)urea is 151928-40-4.
The molecular formula of 1-(2-Iodoethyl)-3-(4-methylphenyl)urea is C10H13IN2O.
The molecular weight of 1-(2-Iodoethyl)-3-(4-methylphenyl)urea is 304.00726 g/mol.
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