TL;DR: Oxazole, 4,5-diphenyl-2-((ethylamino)methyl)-, monohydrochloride (CAS 162739-25-5) is a chemical compound with molecular formula C18H19ClN2O and molecular weight 314.1186 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(4,5-diphenyl-1,3-oxazol-2-yl)methyl]ethanamine;hydrochloride
Also Known As: 4,5-Diphenyl-2-((ethylamino)methyl)oxazole monohydrochloride, Oxazole, 4,5-diphenyl-2-((ethylamino)methyl)-, monohydrochloride, n-[(4,5-diphenyl-1,3-oxazol-2-yl)methyl]ethanamine hydrochloride(1:1), N-[(4,5-diphenyl-1,3-oxazol-2-yl)methyl]ethanamine hydrochloride, N-[(4,5-Diphenyl-1,3-oxazol-2-yl)methyl]ethanamine--hydrogen chloride (1/1)
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C18H19ClN2O |
| Molecular Weight | 314.1186 g/mol |
| XLogP | 4.5399 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.1186 Da |
| Heavy Atoms | 22 |
| Complexity | 298.0 |
| SMILES | CCNCC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3.Cl |
| InChIKey | KYOXZFRDHWEYGF-UHFFFAOYSA-N |
The XLogP value of 4.5399 indicates that Oxazole, 4,5-diphenyl-2-((ethylamino)methyl)-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.1 Ų, Oxazole, 4,5-diphenyl-2-((ethylamino)methyl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxazole, 4,5-diphenyl-2-((ethylamino)methyl)-, monohydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Oxazole, 4,5-diphenyl-2-((ethylamino)methyl)-, monohydrochloride is 162739-25-5.
The molecular formula of Oxazole, 4,5-diphenyl-2-((ethylamino)methyl)-, monohydrochloride is C18H19ClN2O.
The molecular weight of Oxazole, 4,5-diphenyl-2-((ethylamino)methyl)-, monohydrochloride is 314.1186 g/mol.
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