TL;DR: 6-Acetylmorphine (CAS 152477-90-2) is a chemical compound with molecular formula C19H21NO4 and molecular weight 327.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(9-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl) acetate
Also Known As: 6-Acetylmorphine, 6-Monoacetylmorphine, Monoacetylmorphine, Morphine 6-acetate, 6-O-Acetylmorphine
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C19H21NO4 |
| Molecular Weight | 327.14706 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.14706 Da |
| Heavy Atoms | 24 |
| Complexity | 592.0 |
| SMILES | CC(=O)OC1C=CC2C3CC4=C5C2(C1OC5=C(C=C4)O)CCN3C |
| InChIKey | JJGYGPZNTOPXGV-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Acetylmorphine. With a topological polar surface area (TPSA) of 59.0 Ų, 6-Acetylmorphine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Acetylmorphine 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 6-Acetylmorphine is 152477-90-2.
The molecular formula of 6-Acetylmorphine is C19H21NO4.
The molecular weight of 6-Acetylmorphine is 327.14706 g/mol.
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