TL;DR: Anhydro Vinblastine Disulfate Salt (CAS 1219117-51-7) is a chemical compound with molecular formula C46H56N4O8 and molecular weight 792.4098 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 11-acetyloxy-12-ethyl-4-(17-ethyl-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9,16-pentaen-13-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: Anhydrovinblastine, 3',4'-Anhydrovinblastine, Anhydrovincaleukoblastine, Anhydro Vinblastine Disulfate Salt, 3',4'-Dehydrovinblastine
| Molecular Formula | C46H56N4O8 |
| Molecular Weight | 792.4098 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 134.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 792.4098 Da |
| Heavy Atoms | 58 |
| Complexity | 1710.0 |
| SMILES | CCC1=CC2CC(C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)C78CCN9C7C(C=CC9)(C(C(C8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC |
| InChIKey | FFRFGVHNKJYNOV-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that Anhydro Vinblastine Disulfate Salt is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Anhydro Vinblastine Disulfate Salt. Following Lipinski's Rule of Five, Anhydro Vinblastine Disulfate Salt has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Anhydro Vinblastine Disulfate Salt is 1219117-51-7.
The molecular formula of Anhydro Vinblastine Disulfate Salt is C46H56N4O8.
The molecular weight of Anhydro Vinblastine Disulfate Salt is 792.4098 g/mol.
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