4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one
TL;DR: 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one (CAS 147502-27-0) is a chemical compound with molecular formula C16H15NO2 and molecular weight 253.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-2-phenyl-2,3-dihydro-1,4-benzoxazepin-5-one
Also Known As: Maybridge3_005519, 4-methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one, IDI1_016906, AJ-091/33279060, 4-methyl-2-phenyl-2,3-dihydro-1,4-benzoxazepin-5-one
Technical Specifications
| Molecular Formula | C16H15NO2 |
| Molecular Weight | 253.11028 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.11028 Da |
| Heavy Atoms | 19 |
| Complexity | 325.0 |
| SMILES | CN1CC(OC2=CC=CC=C2C1=O)C3=CC=CC=C3 |
| InChIKey | OQWCUHNHUOOZSX-UHFFFAOYSA-N |
Chemical Property Profile of 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one
Property Insights of 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one. With a topological polar surface area (TPSA) of 29.5 Ų, 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one?
The CAS number of 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one is 147502-27-0.
What is the molecular formula of 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one?
The molecular formula of 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one is C16H15NO2.
What is the molecular weight of 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one?
The molecular weight of 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one is 253.11028 g/mol.
Where can I buy 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one?
You can request a quote for 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one?
Yes, CoreyChem provides custom synthesis services for 4-Methyl-2-phenyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.