TL;DR: (3-Bromooxan-2-yl)urea (CAS 10223-94-6) is a chemical compound with molecular formula C6H11BrN2O2 and molecular weight 222.0004 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-bromooxan-2-yl)urea
Also Known As: (3-bromooxan-2-yl)urea, N-(3-Bromooxan-2-yl)urea, KST-1A9566, 1-(3-bromotetrahydro-2h-pyran-2-yl)urea, Urea,N-(3-bromotetrahydro-2H-pyran-2-yl)-
| Molecular Formula | C6H11BrN2O2 |
| Molecular Weight | 222.0004 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.0004 Da |
| Heavy Atoms | 11 |
| Complexity | 154.0 |
| SMILES | C1CC(C(OC1)NC(=O)N)Br |
| InChIKey | MIWDQSRLLWPQOS-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Bromooxan-2-yl)urea. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Bromooxan-2-yl)urea. Following Lipinski's Rule of Five, (3-Bromooxan-2-yl)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 (3-Bromooxan-2-yl)urea is 10223-94-6.
The molecular formula of (3-Bromooxan-2-yl)urea is C6H11BrN2O2.
The molecular weight of (3-Bromooxan-2-yl)urea is 222.0004 g/mol.
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