TL;DR: 2-([1,1'-Biphenyl]-2-yl)-4,4-dimethyl-4,5-dihydrooxazole (CAS 153500-77-7) is a chemical compound with molecular formula C17H17NO and molecular weight 251.13101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,4-dimethyl-2-(2-phenylphenyl)-5H-1,3-oxazole
Also Known As: 2-Amino-4,6-(1H,5H)-pyrimidinedione, 2-BIPHENYL-2-YL-4,4-DIMETHYL-4,5-DIHYDRO-OXAZOLE, NCI60_036047, 2-(4,4-Dimethyl-2-oxazolin-2-yl)biphenyl, 2-([1,1'-Biphenyl]-2-yl)-4,4-dimethyl-4,5-dihydrooxazole
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H17NO |
| Molecular Weight | 251.13101 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 21.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.13101 Da |
| Heavy Atoms | 19 |
| Complexity | 341.0 |
| SMILES | CC1(COC(=N1)C2=CC=CC=C2C3=CC=CC=C3)C |
| InChIKey | MUFNIUXQTXCXFN-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 2-([1,1'-Biphenyl]-2-yl)-4,4-dimethyl-4,5-dihydrooxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.6 Ų, 2-([1,1'-Biphenyl]-2-yl)-4,4-dimethyl-4,5-dihydrooxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-([1,1'-Biphenyl]-2-yl)-4,4-dimethyl-4,5-dihydrooxazole has 0 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 2-([1,1'-Biphenyl]-2-yl)-4,4-dimethyl-4,5-dihydrooxazole is 153500-77-7.
The molecular formula of 2-([1,1'-Biphenyl]-2-yl)-4,4-dimethyl-4,5-dihydrooxazole is C17H17NO.
The molecular weight of 2-([1,1'-Biphenyl]-2-yl)-4,4-dimethyl-4,5-dihydrooxazole is 251.13101 g/mol.
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