TL;DR: A 51493A (CAS 121245-06-5) is a chemical compound with molecular formula C30H31NO10 and molecular weight 565.1948 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-1-(oxiran-2-yl)ethyl]-11-hydroxy-5-methylnaphtho[2,3-h]chromene-4,7,12-trione
Also Known As: A 51493A, A-51493A, 2-[1-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-1-(oxiran-2-yl)ethyl]-11-hydroxy-5-methylnaphtho[2,3-h]chromene-4,7,12-trione, 2-Hydroxy-1-(11-hydroxy-5-methyl-4,7,12-trioxo-7,12-dihydro-4H-anthra[1,2-b]pyran-2-yl)-1-(oxiran-2-yl)ethyl 2,3,6-trideoxy-3-(dimethylamino)hexopyranoside, T26418
| Molecular Formula | C30H31NO10 |
| Molecular Weight | 565.1948 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 155.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 565.1948 Da |
| Heavy Atoms | 41 |
| Complexity | 1110.0 |
| SMILES | CC1C(C(CC(O1)OC(CO)(C2CO2)C3=CC(=O)C4=C(O3)C5=C(C=C4C)C(=O)C6=C(C5=O)C(=CC=C6)O)N(C)C)O |
| InChIKey | DPEJSNRXRQGSSD-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A 51493A. The TPSA of 155.0 Ų indicates high polarity, suggesting A 51493A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A 51493A has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of A 51493A is 121245-06-5.
The molecular formula of A 51493A is C30H31NO10.
The molecular weight of A 51493A is 565.1948 g/mol.
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