TL;DR: N-1-adamantyl-N'-(2-furylmethyl)urea (CAS 123614-33-5) is a chemical compound with molecular formula C16H22N2O2 and molecular weight 274.16812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1-adamantyl)-3-(furan-2-ylmethyl)urea
Also Known As: N-1-adamantyl-N'-(2-furylmethyl)urea, 1-(1-adamantyl)-3-(furan-2-ylmethyl)urea, N-adamantanyl[(2-furylmethyl)amino]carboxamide, N-(1-ADAMANTYL)-N'-(2-FURYLMETHYL)UREA, 1-((3s,5s,7s)-adamantan-1-yl)-3-(furan-2-ylmethyl)urea
| Molecular Formula | C16H22N2O2 |
| Molecular Weight | 274.16812 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 54.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.16812 Da |
| Heavy Atoms | 20 |
| Complexity | 355.0 |
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=O)NCC4=CC=CO4 |
| InChIKey | PVLMCWNVTQFSDP-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-1-adamantyl-N'-(2-furylmethyl)urea. With a topological polar surface area (TPSA) of 54.3 Ų, N-1-adamantyl-N'-(2-furylmethyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-1-adamantyl-N'-(2-furylmethyl)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 N-1-adamantyl-N'-(2-furylmethyl)urea is 123614-33-5.
The molecular formula of N-1-adamantyl-N'-(2-furylmethyl)urea is C16H22N2O2.
The molecular weight of N-1-adamantyl-N'-(2-furylmethyl)urea is 274.16812 g/mol.
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