TL;DR: 1-(4-Chlorophenyl)-3-(2-piperidin-1-ylethyl)urea (CAS 121145-86-6) is a chemical compound with molecular formula C14H20ClN3O and molecular weight 281.1295 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-chlorophenyl)-3-(2-piperidin-1-ylethyl)urea
Also Known As: 1-(4-chlorophenyl)-3-(2-piperidin-1-ylethyl)urea, 3-(4-chlorophenyl)-1-[2-(1-piperidyl)ethyl]urea, 1-(4-chlorophenyl)-3-[2-(piperidin-1-yl)ethyl]urea, N-(4-chlorophenyl)-N'-[2-(1-piperidinyl)ethyl]urea, N-(4-CHLOROPHENYL)-N'-(2-PIPERIDINOETHYL)UREA
| Molecular Formula | C14H20ClN3O |
| Molecular Weight | 281.1295 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 44.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.1295 Da |
| Heavy Atoms | 19 |
| Complexity | 274.0 |
| SMILES | C1CCN(CC1)CCNC(=O)NC2=CC=C(C=C2)Cl |
| InChIKey | RKOIPCNLDUQOEU-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chlorophenyl)-3-(2-piperidin-1-ylethyl)urea. With a topological polar surface area (TPSA) of 44.4 Ų, 1-(4-Chlorophenyl)-3-(2-piperidin-1-ylethyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-3-(2-piperidin-1-ylethyl)urea 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 1-(4-Chlorophenyl)-3-(2-piperidin-1-ylethyl)urea is 121145-86-6.
The molecular formula of 1-(4-Chlorophenyl)-3-(2-piperidin-1-ylethyl)urea is C14H20ClN3O.
The molecular weight of 1-(4-Chlorophenyl)-3-(2-piperidin-1-ylethyl)urea is 281.1295 g/mol.
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