TL;DR: 21H,23H-Porphine, 2,3,7,8,12,13,17,18-octaethyl-, zinc complex (CAS 135770-41-1) is a chemical compound with molecular formula C36H44N4NaZn- and molecular weight 619.2755 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
sodium;2,3,7,8,12,13,17,18-octaethylporphyrin-21,22-diide;zinc
Also Known As: 21H,23H-Porphine, 2,3,7,8,12,13,17,18-octaethyl-, zinc complex, Zincate(1-), (2,3,7,8,12,13,17,18-octaethyl-21H,23H-porphinato(2-)-N21,N22,N23,N24)-, sodium, (SP-4-1), sodium; 2,3,7,8,12,13,17,18-octaethylporphyrin-21,22-diide; zinc
| Molecular Formula | C36H44N4NaZn- |
| Molecular Weight | 619.2755 g/mol |
| XLogP | 6.2857 |
| Topological Polar Surface Area (TPSA) | 27.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 619.2755 Da |
| Heavy Atoms | 42 |
| Complexity | 603.0 |
| SMILES | CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C([N-]5)C=C1[N-]2)CC)CC)C(=C4CC)CC)C(=C3CC)CC)CC.[Na+].[Zn] |
| InChIKey | HCRFQJDXYFNRLO-UHFFFAOYSA-N |
The XLogP value of 6.2857 indicates that 21H,23H-Porphine, 2,3,7,8,12,13,17,18-octaethyl-, zinc complex is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.8 Ų, 21H,23H-Porphine, 2,3,7,8,12,13,17,18-octaethyl-, zinc complex exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 21H,23H-Porphine, 2,3,7,8,12,13,17,18-octaethyl-, zinc complex has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 21H,23H-Porphine, 2,3,7,8,12,13,17,18-octaethyl-, zinc complex is 135770-41-1.
The molecular formula of 21H,23H-Porphine, 2,3,7,8,12,13,17,18-octaethyl-, zinc complex is C36H44N4NaZn-.
The molecular weight of 21H,23H-Porphine, 2,3,7,8,12,13,17,18-octaethyl-, zinc complex is 619.2755 g/mol.
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