TL;DR: RefChem:241551 (CAS 104837-22-1) is a chemical compound with molecular formula C26H23ClN2O4 and molecular weight 462.13464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(2-chlorobenzoyl)-3-[(4-hydroxy-4-phenylpiperidin-1-yl)methyl]-1,3-benzoxazol-2-one
Also Known As: 2(3H)-Benzoxazolone, 6-(2-chlorobenzoyl)-3-((4-hydroxy-4-phenyl-1-piperidinyl)methyl)-, 6-(2-Chlorobenzoyl)-3-((4-hydroxy-4-phenyl-1-piperidinyl)methyl)-2(3H)-benzoxazolone, 6-(2-chlorobenzoyl)-3-[(4-hydroxy-4-phenylpiperidin-1-yl)methyl]-1,3-benzoxazol-2-one, 6-(2-Chlorobenzoyl)-3-[(4-hydroxy-4-phenylpiperidin-1-yl)methyl]-1,3-benzoxazol-2(3H)-one
| Molecular Formula | C26H23ClN2O4 |
| Molecular Weight | 462.13464 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 70.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 462.13464 Da |
| Heavy Atoms | 33 |
| Complexity | 719.0 |
| SMILES | C1CN(CCC1(C2=CC=CC=C2)O)CN3C4=C(C=C(C=C4)C(=O)C5=CC=CC=C5Cl)OC3=O |
| InChIKey | FLAKAXVPFIMUPW-UHFFFAOYSA-N |
The XLogP value of 4.6 indicates that RefChem:241551 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:241551. Following Lipinski's Rule of Five, RefChem:241551 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:241551 is 104837-22-1.
The molecular formula of RefChem:241551 is C26H23ClN2O4.
The molecular weight of RefChem:241551 is 462.13464 g/mol.
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