TL;DR: Epirubicin Hydrochloride (CAS 56390-09-1) is a chemical compound with molecular formula C27H30ClNO11 and molecular weight 579.15076 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(7S,9S)-7-[(2R,4S,5R,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride
Also Known As: Epirubicin hydrochloride, Epirubicin HCl, Ellence, Pharmorubicin, Farmorubicin
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C27H30ClNO11 |
| Molecular Weight | 579.15076 g/mol |
| XLogP | 0.42 |
| Topological Polar Surface Area (TPSA) | 206.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 579.15076 Da |
| Heavy Atoms | 40 |
| Complexity | 977.0 |
| SMILES | C[C@H]1[C@@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O.Cl |
| InChIKey | MWWSFMDVAYGXBV-FGBSZODSSA-N |
The XLogP value of 0.42 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Epirubicin Hydrochloride. The TPSA of 206.0 Ų indicates high polarity, suggesting Epirubicin Hydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Epirubicin Hydrochloride has 7 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Epirubicin Hydrochloride is 56390-09-1.
The molecular formula of Epirubicin Hydrochloride is C27H30ClNO11.
The molecular weight of Epirubicin Hydrochloride is 579.15076 g/mol.
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