TL;DR: Vanadyl-chlorine e(6) (CAS 133162-62-6) is a chemical compound with molecular formula C34H31N4Na3O6V and molecular weight 711.13763 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trisodium;3-[20-(carboxylatomethyl)-18-(dioxidomethylidene)-8-ethenyl-13-ethyl-3,7,12,17-tetramethyl-2,3-dihydroporphyrin-23-id-2-yl]propanoate;vanadium(2+)
Also Known As: Vanadyl-chlorine e(6), Vanadyl-chlorophyl-a complex, (48V)-Vanadyl-chlorine e(6) Na, trisodium, Vanadyl-chlorophyl-a complex, Vanadate(3-), (18-carboxy-20-(carboxymethyl)-8-ethenyl-13-ethyl-2,3-dihydro-3,7,12,17-tetramethyl-21H-23H-porphine-2-propanoato(2-)-N21,N22,N23,N24)-, trisodium, (SP-4-2-(2S-trans))-
| Molecular Formula | C34H31N4Na3O6V |
| Molecular Weight | 711.13763 g/mol |
| XLogP | -9.76838 |
| Topological Polar Surface Area (TPSA) | 164.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 711.13763 Da |
| Heavy Atoms | 48 |
| Complexity | 1750.0 |
| SMILES | CCC1=C(C2=CC3=NC(=CC4=NC(=C(C5=NC(=C(C5=C([O-])[O-])C)C=C1[N-]2)CC(=O)[O-])C(C4C)CCC(=O)[O-])C(=C3C=C)C)C.[Na+].[Na+].[Na+].[V+2] |
| InChIKey | KQOIZXDVRGCTNI-UHFFFAOYSA-I |
The XLogP value of -9.76838 indicates that Vanadyl-chlorine e(6) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 164.0 Ų indicates high polarity, suggesting Vanadyl-chlorine e(6) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Vanadyl-chlorine e(6) has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Vanadyl-chlorine e(6) is 133162-62-6.
The molecular formula of Vanadyl-chlorine e(6) is C34H31N4Na3O6V.
The molecular weight of Vanadyl-chlorine e(6) is 711.13763 g/mol.
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