TL;DR: Nomegestrol (CAS 58691-88-6) is a chemical compound with molecular formula C21H28O3 and molecular weight 328.20386 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8S,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,13-dimethyl-1,2,8,9,10,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: Nomegestrol, Nomegestrolum, Thermex, Monaco, Lutenyl
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H28O3 |
| Molecular Weight | 328.20386 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 328.20386 Da |
| Heavy Atoms | 24 |
| Complexity | 673.0 |
| SMILES | CC1=C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)O)C)[C@@H]4C1=CC(=O)CC4 |
| InChIKey | KZUIYQJTUIACIG-YBZCJVABSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nomegestrol. With a topological polar surface area (TPSA) of 54.4 Ų, Nomegestrol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nomegestrol has 1 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 Nomegestrol is 58691-88-6.
The molecular formula of Nomegestrol is C21H28O3.
The molecular weight of Nomegestrol is 328.20386 g/mol.
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