TL;DR: Orazipone (CAS 137109-78-5) is a chemical compound with molecular formula C13H14O4S and molecular weight 266.06128 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(4-methylsulfonylphenyl)methylidene]pentane-2,4-dione
Also Known As: Orazipone, orazipona, oraziponum, Orazipone [INN], OR 1384
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H14O4S |
| Molecular Weight | 266.06128 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 76.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.06128 Da |
| Heavy Atoms | 18 |
| Complexity | 444.0 |
| SMILES | CC(=O)C(=CC1=CC=C(C=C1)S(=O)(=O)C)C(=O)C |
| InChIKey | CAWYWWPWSAMGBV-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Orazipone. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Orazipone. Following Lipinski's Rule of Five, Orazipone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Orazipone is 137109-78-5.
The molecular formula of Orazipone is C13H14O4S.
The molecular weight of Orazipone is 266.06128 g/mol.
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