TL;DR: Navelbine monotartrate (CAS 115664-56-7) is a chemical compound with molecular formula C49H62N4O14 and molecular weight 930.4263 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3R)-2,3-dihydroxybutanedioic acid;methyl (9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-4-[(12S,14S)-16-ethyl-12-methoxycarbonyl-1,10-diazatetracyclo[12.3.1.03,11.04,9]octadeca-4,6,8,15-tetraen-12-yl]-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate
Also Known As: Navelbine monotartrate, Vinorelbine tartrate, Vinorelbine Bitartrate, Vinorelbine monotartrate, methyl(2
| Molecular Formula | C49H62N4O14 |
| Molecular Weight | 930.4263 g/mol |
| XLogP | 2.1793 |
| Topological Polar Surface Area (TPSA) | 245.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 13 |
| Exact Mass | 930.4263 Da |
| Heavy Atoms | 67 |
| Complexity | 1820.0 |
| SMILES | CCC1=C[C@@H]2C[C@@](C3C(CN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)C78CCN9[C@H]7[C@@](C=CC9)([C@H]([C@@]([C@@H]8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O |
| InChIKey | UAXNMTICKQUESH-DDDIARMZSA-N |
The XLogP value of 2.1793 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Navelbine monotartrate. The TPSA of 245.0 Ų indicates high polarity, suggesting Navelbine monotartrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Navelbine monotartrate has 6 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Navelbine monotartrate is 115664-56-7.
The molecular formula of Navelbine monotartrate is C49H62N4O14.
The molecular weight of Navelbine monotartrate is 930.4263 g/mol.
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